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[Header]

Data File Name E:\Nilam\Minyak Nilam 5 160919.qgd


Output Date 12/3/2019
Output Time 8:36:51 AM

[File Information]
Type Data File
Generated 9/16/2019 2:05:24 PM
Generated by Admin
Modified 9/18/2019 5:03:40 PM
Modified by Admin

[Sample Information]
Operator Name Admin
Analyzed 9/16/2019 2:08:22 PM
Type Unknown
Level 1
Sample Name
Sample ID
ISTD Amount 1 1
ISTD Amount 2 1
ISTD Amount 3 1
ISTD Amount 4 1
ISTD Amount 5 1
ISTD Amount 6 1
ISTD Amount 7 1
ISTD Amount 8 1
ISTD Amount 9 1
ISTD Amount 10 1
ISTD Amount 11 1
ISTD Amount 12 1
ISTD Amount 13 1
ISTD Amount 14 1
ISTD Amount 15 1
ISTD Amount 16 1
ISTD Amount 17 1
ISTD Amount 18 1
ISTD Amount 19 1
ISTD Amount 20 1
ISTD Amount 21 1
ISTD Amount 22 1
ISTD Amount 23 1
ISTD Amount 24 1
ISTD Amount 25 1
ISTD Amount 26 1
ISTD Amount 27 1
ISTD Amount 28 1
ISTD Amount 29 1
ISTD Amount 30 1
ISTD Amount 31 1
ISTD Amount 32 1
Sample Amount 1
Dilution Factor 1
Vial# 2
Injection Volume 0.2
Injection Count 1
Bar Code

[Original Files]
Data File E:\Nilam\Minyak Nilam 5 160919.qgd
Method File E:\151015 Minyak Nilam Wax.qgm
Batch File (Untitled)
Report Format File C:\GCMSsolution\Project1\Area Normalization_DeA dan
Library.qgr
Tuning File C:\GCMSsolution\System\Tune1\160919 tuning1.qgt

[File Description]

[MS Quantitative Results]


# of IDs 5
ID# Name Type ISTD Group# Mass Ret.Time Start Time End Time A/H Area
Height Conc. Mode Peak# Std.Ret.Time Calibration Curve 3rd 2nd
1st Constant Ref.Ion Area Ref.Ion Height Ref.Ion Set Ratio
Ref.Ion Ratio Recovery SI
1 .alpha.-Guaiene $$ Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-
methylethenyl) Target 0 TIC 7.312 7.242 7.392 0.223 50837 22766
8.10588 Auto 2 7.308 Default 0 0 0 0 0 0
13.34 14 0.00 98
2 (c-4a,c-7a)-4,4a,5,6,7,7a-Hexahydro-8,8-dimethyl-r-l,c-4-methano-1H-
cyclopenta[d]pyridazine Target 0 TIC 8.228 8.208 8.250 0.185 4862 2622
0.77524 Auto 9 8.225 Default 0 0 0 0 0 0
48.58 50 0.00 98
3 Benzenemethanol, 4-methyl- (CAS) p-Methylbenzyl alcohol $$ p-Tolylcarbinol
Target 0 TIC 8.321 8.292 8.383 0.186 12440 6683 1.98354 Auto
15 8.325 Default 0 0 0 0 0 0 35.87 41 0.00
95
4 Azulene, 1,2,3,5,6,7,8,8a-octahydro-1,4-dimethyl-7-(1-methylethenyl) Target
0 TIC 9.745 9.708 9.825 0.276 111461 40363 17.77228 Auto 17
9.742 Default 0 0 0 0 0 0 10.23 10 0.00 98
5 Patchouli alcohol Target 0 TIC 20.145 20.067 20.592
0.477 447562 93710 71.36306 Auto 23 20.142 Default 0
0 0 0 0 0 5.53 5 0.00 99

[MS Similarity Search Results for Identified Results]


# of IDs 5
ID# Hit # SI CAS # Name Mol.Weight Mol.Form CLASS1 CLASS2 CLASS3
CLASS4 CLASS5 Retention Index Description Serial # Library Name
[MC Peak Table]
# of Peaks 5
Mass TIC
Peak# Ret.Time Proc.From Proc.To Mass Area Height A/H Conc. Mark
Name
1 7.312 7.275 7.375 TIC 49584 22641 2.19 8.27 .alpha.-Guaiene $$
Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)
2 8.225 8.200 8.292 TIC 5170 2634 1.96 0.86 (c-4a,c-7a)-
4,4a,5,6,7,7a-Hexahydro-8,8-dimethyl-r-l,c-4-methano-1H-cyclopenta[d]pyridazine
3 8.321 8.292 8.375 TIC 12372 6674 1.85 2.06 Benzenemethanol, 4-
methyl- (CAS) p-Methylbenzyl alcohol $$ p-Tolylcarbinol
4 9.745 9.708 9.825 TIC 111101 40331 2.75 18.53 Azulene,
1,2,3,5,6,7,8,8a-octahydro-1,4-dimethyl-7-(1-methylethenyl)
5 20.145 20.075 20.317 TIC 421276 92923 4.53 70.27
Patchouli alcohol

[MS Column Performance Table]


# of Peaks 5
Peak# k' Plate # Plate Ht. Tailing Resolution Separation Factor
Ret.Time Name
1 0.000 162129 0.0 1.336 0.000 0.000 7.312 .alpha.-Guaiene $$ Azulene,
1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)
2 0.125 559096 0.0 1.268 15.664 0.000 8.225 (c-4a,c-7a)-
4,4a,5,6,7,7a-Hexahydro-8,8-dimethyl-r-l,c-4-methano-1H-cyclopenta[d]pyridazine
3 0.138 517923 0.0 1.297 2.131 1.105 8.321 Benzenemethanol, 4-methyl-
(CAS) p-Methylbenzyl alcohol $$ p-Tolylcarbinol
4 0.333 209623 0.0 1.479 21.667 2.410 9.745 Azulene,
1,2,3,5,6,7,8,8a-octahydro-1,4-dimethyl-7-(1-methylethenyl)
5 1.755 401626 0.0 1.745 97.987 5.275 20.145 Patchouli alcohol

[Spectrum Process Table]


# of Spectrum 5
Raw Spectrum Background
Spectrum# Top Start End Top Start End
1 7.308 0.000 0.000 7.258 0.000 0.000
2 8.225 0.000 0.000 8.200 0.000 0.000
3 8.325 0.000 0.000 8.383 0.000 0.000
4 9.742 0.000 0.000 9.692 0.000 0.000
5 20.142 0.000 0.000 20.067 0.000 0.000
[MS Similarity Search Results for Spectrum Process Table]
# of Spectrum 5
Spectrum# Hit # SI CAS # Name Mol.Weight Mol.Form CLASS1 CLASS2
CLASS3 CLASS4 CLASS5 Retention Index Description Serial #
Library Name
1 1 78 61827 - 89 - 2 3,9-Dodecadiyne $$ 162 C12H18
0 20350 C:\GCMSsolution\Library\NIST147.LIB
1 2 78 0 - 00 - 0 .gamma.-epoxy-elemene $$ 220 C15 H24 O
0 120433 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
1 3 76 142133 - 75 - 3 bis{Bicyclo[2.1.1] hexane $$ 162 C12
H18 0 51200
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 4 76 0 - 00 - 0 Gamma-Cadinene $$ 204 C15 H24
0 101119 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
1 5 76 65691 - 78 - 3 1-ETHYNYL-2-METHYL-1(E)-CYCLODODECENE $$
Cyclododecene, 1-ethynyl-2-methyl-, (E)- (CAS) 204 C15 H24
0 100184 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
1 6 75 80993 - 96 - 0 15,16,17-Trinorxeniaphylla-4,8(19)-dien-14-al $
$ Bicyclo[7.2.0]undec-5-ene-10-propanal, 6,10-dimethyl-2-methylene- (CAS) 246
C17 H26 O 0 152418
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 7 74 24568 - 69 - 2 (1.alpha.,4.alpha.,4a.beta.,5.alpha.,8a.beta.)-
Decahydro-1,4,8a-trimethyl-9-methylene-1,5-methanonaphthalene $$ (+-)-
isoseychellene $$ (+-)-Seychellene $$ 1,6-Methanonaphthalene, decahydro-1,4,8a-
trimethyl-9-methylene-, (1.alpha.,4.alpha.,4a.beta.,6.alpha.,8a.beta.)-(.+-.)-
(CAS) 1,6-Methanonaphthalene, 1,2,3,4,4a.alpha.,5,6.alpha.,7,8,8a-decahydro-
1.alpha.,4.beta.,8a.al pha.-trimethyl-9-methylene-, (.+-.)- (CAS) (.+-.)-
Seychellene $$ 204 C15 H24 0 101145
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 8 74 3691 - 12 - 1 .alpha.-Guaiene $$ Azulene, 1,2,3,4,5,6,7,8-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]-
(CAS) .ALPHA.-GUAIEN $$ Guaia-1(5),11-diene $$ 204 C15 H24
0 100814 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
1 9 74 3691 - 12 - 1 Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-
dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]- $$ Guaia-1(5),11-
diene $$ .alpha.-Guaiene $$ 7-Isopropenyl-1,4-dimethyl-1,2,3,4,5,6,7,8-
octahydroazulene # $$ 204 C15H24 0
42320 C:\GCMSsolution\Library\NIST147.LIB
1 10 74 21747 - 46 - 6 Ledene $$ 1H-Cycloprop[e]azulene,
1a,2,3,5,6,7,7a,7b-octahydro-1,1,4,7-tetramethyl-, [1aR-
(1a.alpha.,7.alpha.,7a.beta.,7b.alpha.)]- $$ Viridiflorene $$ (+)-Ledene $$ 1H-
Cycloprop[e]azulene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,4,7-tetramethyl-, (+)- (CAS)
204 C15 H24 0 101024
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 11 73 3691 - 12 - 1 .alpha.-Guaiene $$ Azulene, 1,2,3,4,5,6,7,8-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]-
(CAS) .ALPHA.-GUAIEN $$ Guaia-1(5),11-diene $$ ALPHA-GUAIENE $$ ALPHA-GUAIEN $$
Azulene, 1,2,3,4,5,6,7,8-octahydro-7.beta.-isopropenyl-1.beta.,4.beta.-dimeth yl-
(CAS) 204 C15 H24 0 100818
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 12 73 0 - 00 - 0 1,4-Methanocycloocta[d]pyridazine,
1,4,4a,5,6,9,10,10a-octahydro-11,11-dimethyl-,
(1.alpha.,4.alpha.,4a.alpha.,10a.alpha.)- $$ 204 C13H20N2
0 42139 C:\GCMSsolution\Library\NIST147.LIB
1 13 73 84642 - 42 - 2 2,2-Diisobutenyl-3-cyclohepten-1-one $$ 3-
Cyclohepten-1-one, 2,2-bis(2-methyl-2-propenyl)- (CAS) 218 C15 H22 O
0 117670 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
1 14 72 0 - 00 - 0 CLOVEN N $$ 204 C15 H24
0 100361 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
1 15 72 0 - 00 - 0 Tricyclo[7.2.0.0(3,8)]undec-4-ene, 4,8,11,11-
tetramethyl- $$ 1,1,2b,6-Tetramethyl-2,2a,2b,3,4,6a,7,7a-octahydro-1H-
cyclobuta[a]indene # $$ 204 C15H24 0
42234 C:\GCMSsolution\Library\NIST147.LIB
1 16 72 23623 - 26 - 9 (E)-2-methyl-5-[(1.alpha.,6.alpha.,7.alpha.)-3-
(hydroxymethyl)-7-methylbicyclo[4.1.0]hept-2-en-7-yl]-2-penten-1-ol $$
Bicyclo[4.1.0]hept-2-ene-3-methanol, 7-(5-hydroxy-4-methyl-3-pentenyl)-7-methyl-,
[1.alpha.,6.alpha.,7.alpha.(E)]-(.+-.)- (CAS) 2-Norcarene-3-methanol, 7-(5-hydroxy-
4-methyl-3-pentenyl)-7-methyl-, stereoisomer (CAS) (.+-.)-Sirenin $$ DL-Sirenin $$
236 C15 H24 O2 0 140504
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 17 72 65018 - 15 - 7 (-)-.alpha.-Costol $$ 2-Naphthaleneethanol,
1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-.beta.-methylene-, [2R-
(2.alpha.,4a.alpha.,8a.beta.)]- (CAS) .alpha.-Costol $$ 220 C15 H24 O
0 120369 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
1 18 72 0 - 00 - 0 4-(E)-Cyclohexyl-3-methylenecyclobut-3-en-1-yl
mesylate $$ 244 C12 H20 O3 S 0
149526 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 19 72 65018 - 15 - 7 (+)-.BETA.-COSTOL $$ 220 C15 H24 O
0 120370 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
1 20 72 87 - 44 - 5 trans-Caryophyllene $$ Bicyclo[7.2.0]undec-4-ene,
4,11,11-trimethyl-8-methylene-, [1R-(1R*,4E,9S*)]- (CAS) l-Caryophyllene $$ (-)-
Caryophyllene $$ Caryophyllene $$ .beta.-Caryophyllen $$ .beta.-Caryophyllene $$
.beta.-Caryophyllene, (-) $$ Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-
methylene-, (E)-(1R,9S)-(-)- $$ (-)-.beta.-Caryophyllene $$ CARYOPHYLLEN $$ BETA-
CARYOPHYLLENE $$ 4,11,11-trimethylbicyclo[7.2.0]undec-4-ene $$ Bicyclo[7.2.0]undec-
4-ene, 4,11,11-trimethyl-8-methylene-, [1R-(1R@,4E,9S@)]- $$ 204 C15 H24
0 100795
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 21 72 3691 - 12 - 1 .alpha.-Guaiene $$ Azulene, 1,2,3,4,5,6,7,8-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]-
(CAS) .ALPHA.-GUAIEN $$ Guaia-1(5),11-diene $$ ALPHA-GUAIENE $$ ALPHA-GUAIEN $$
Azulene, 1,2,3,4,5,6,7,8-octahydro-7.beta.-isopropenyl-1.beta.,4.beta.-dimeth yl-
(CAS) 204 C15 H24 0 100815
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 22 71 17334 - 55 - 3 Calarene $$ 1H-Cyclopropa[a]naphthalene,
1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-, [1aR-
(1a.alpha.,7.alpha.,7a.alpha.,7b.alpha.)]- (CAS) .beta.-Gurjunene $$ 1(10)-
Aristolene, (+)- $$ .delta.1(10)-Aristolene $$ 1H-Cyclopropa[a]naphthalene,
1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-, (1aR,7R,7aR,7bS)-(+)- $$ BETA-
GURJUNENE $$ (+)-Calarene $$ (+)-.DELTA.1(10)-Aristolene $$ (+)-1(10)-Aristolene $$
204 C15 H24 0 101032
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 23 71 70240 - 38 - 9 (E)-3-(4-METHYL-3-CYCLOHEXENYL)BUT-2-ENYL
BROMIDE $$ Cyclohexene, 4-(3-bromo-1-methyl-1-propenyl)-1-methyl-, (E)-(.+-.)-
(CAS) 228 C11 H17 BR 0 130369
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 24 71 132636 - 41 - 0 Q $$ 7-[1-E-prop-1-enyl]cycloocta-1,4-diene $$
148 C11 H16 0 36192
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
1 25 71 3691 - 12 - 1 .alpha.-Guaiene $$ Azulene, 1,2,3,4,5,6,7,8-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]-
(CAS) .ALPHA.-GUAIEN $$ Guaia-1(5),11-diene $$ ALPHA-GUAIENE $$ ALPHA-GUAIEN $$
Azulene, 1,2,3,4,5,6,7,8-octahydro-7.beta.-isopropenyl-1.beta.,4.beta.-dimeth yl-
(CAS) 204 C15 H24 0 100816
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 1 92 89703 - 46 - 8 (c-4a,c-7a)-4,4a,5,6,7,7a-Hexahydro-8,8-
dimethyl-r-l,c-4-methano-1H-cyclopenta[d]pyridazine $$ 1,4-Methano-1H-
cyclopenta[d]pyridazine, 4,4a,5,6,7,7a-hexahydro-8,8-dimethyl-,
(1.alpha.,4.alpha.,4a.alpha.,7a.alpha.)- (CAS)
(1.alpha.,4.alpha.,4a.alpha.7a.alpha)-4,4a,5,6,7,7a-hexahydro-8,8-dimethyl-1,4-
methano-1H-cyclopenta[d]pyridazine $$ 164 C10 H16 N2
0 53775 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 2 90 89703 - 46 - 8 (c-4a,c-7a)-4,4a,5,6,7,7a-Hexahydro-8,8-
dimethyl-r-l,c-4-methano-1H-cyclopenta[d]pyridazine $$ 1,4-Methano-1H-
cyclopenta[d]pyridazine, 4,4a,5,6,7,7a-hexahydro-8,8-dimethyl-,
(1.alpha.,4.alpha.,4a.alpha.,7a.alpha.)- (CAS)
(1.alpha.,4.alpha.,4a.alpha.7a.alpha)-4,4a,5,6,7,7a-hexahydro-8,8-dimethyl-1,4-
methano-1H-cyclopenta[d]pyridazine $$ 164 C10 H16 N2
0 53776 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 3 86 0 - 00 - 0 8-Deoxytetrahydrovernolepin $$ 264 C15 H20 O4
0 172743
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 4 82 6932 - 62 - 3 THREO-1,2-DIPHENYLETHAN-2-D-OL $$ threo-2-
Deuterio-1,2-diphenylethanol $$ 198 C14 H13 D O
0 93696 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 5 81 0 - 00 - 0 endo-2,4-dimethylbicyclo[3.2.1]oct-2-en-7-one $$
150 C10 H14 O 0 37868
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 6 80 61505 - 17 - 7 1,4-dimethyl-1-(1'-methyl-2'-methylene-
cyclopentyl)-cyclohex-3-ene $$ 204 C15 H24
0 100313 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 7 78 0 - 00 - 0 (+-)-(3aR*,11R*,11aR*,12R*11bS*,13aS*,14S*)-Methyl
11,14-Diacetoxy-9-oxo-12H-1,12-ethano-2,3,10,11,11a,11b,13,13a-octahydro-9H-
pyrido[1,2,3-lm]pyrrolo[2,3-d]carbazole $$ 410 C22 H38 N2 O5
0 288871 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
2 8 78 62617 - 81 - 6 TRANS-1,6-DIMETHYLBICYCLO(4.3.0)NON-2-EN-7-ONE
$$ 1H-Inden-1-one, 2,3,3a,6,7,7a-hexahydro-3a,7a-dimethyl-, trans- (CAS) 164
C11 H16 O 0 53037
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 9 76 55370 - 39 - 3 1,2,3,4,5,8,9,10,11,12,13,16-
DODECAHYDRODIBENZO[D,J][1,2,7,8]TETRATHIACYCLODODECIN $$ Dibenzo[d,j]
[1,2,7,8]tetrathiacyclododecin, 1,2,3,4,5,8,9,10,11,12,13,16-dodecahydro- (CAS)
Dibenzo[d,j][1,2,7,8]tetrathiacyclododecin,1,2,3,4,5,8,9,10,11,12,13,16-
dodecahydro- $$ 344 C16 H24 S4 0 250067
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 10 75 124266 - 45 - 1 2-methyl-2-(5-hexenyl)-4-(phenylsulfonyl)-3-
sulfolene $$ 354 C17 H22 O4 S2 0
256603 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 11 74 55370 - 34 - 8 1,4,5,6,7,8-HEXAHYDROBENZO(D)(1,2)DITHIINE $$
2,3-Benzodithiin, 1,4,5,6,7,8-hexahydro- (CAS) 172 C8 H12 S2
0 62213 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 12 72 79 - 92 - 5 Camphene $$ Bicyclo[2.2.1]heptane, 2,2-dimethyl-3-
methylene- (CAS) 3,3-Dimethyl-2-methylenenorbornane $$ 2,2-Dimethyl-3-
methylenenorbornane $$ 3,3-Dimethyl-2-methylenenorcamphane $$ 2,2-Dimethyl-3-
methylenebicyclo[2.2.1]heptane $$ NA 9011 $$ CAMPHEN $$ 136 C10 H16
0 26405 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
2 13 70 14938 - 35 - 3 Phenol, 4-pentyl- (CAS) p-n-Amylphenol $$ p-
Amylphenol $$ 4-Amylphenol $$ p-Pentylphenol $$ 4-Pentylphenol $$ Phenol, p-pentyl-
$$ Amyl p-hydroxybenzene $$ 4-n-amylphenol $$ 4-PENTYL-PHENOL $$ 4-n-Pentylphenol $
$ 164 C11 H16 O 0 53803
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 14 70 0 - 00 - 0 1-Propanone, 1-[6-(2-methylcyclopentyl)-1,4-
cyclohexadien-1-yl]-2,2-dimethyl- $$ 246 C17 H26 O
0 152439 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 15 70 14938 - 35 - 3 Phenol, 4-pentyl- 164 C11H16O
0 11074 C:\GCMSsolution\Library\NIST27.LIB
2 16 70 39900 - 23 - 7 (2S,6R,7R)-2,7-EPOXYDIHYDRO-ALPHA-IONONE $$
(2S,6R,7R)-2,7-Epoxydihydro-.alpha.-ionone $$ Ethanone, 1-[3-(2,6,6-trimethyl-2-
cyclohexen-1-yl)oxiranyl]-, [2.alpha.,3.beta.(R*)]- (CAS) 7,8-Epoxydihydro-.alpha.-
ionone $$ 208 C13 H20 O2 0 105489
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 17 70 0 - 00 - 0 4-(1-hydroxyethyl)-2-methyl-1-cyclohexanol $$ 140
C9 H16 O 0 29268
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 18 70 128386 - 70 - 9 (E)-4-methylhepta-1,2,5-triene $$ 1,2,5-
Heptatriene, 4-methyl-, (E)-(.+-.)- (CAS) 108 C8 H12
0 9239 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 19 70 2417 - 81 - 4 1,3-Cyclohexadiene, 5,6-dimethyl-, trans- (CAS)
108 C8 H12 0 9540
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 20 70 131236 - 48 - 1 1-methylene-4-butylcyclohex-3-ene $$
Cyclohexene, 1-butyl-4-methylene- (CAS) 150 C11 H18
0 38111 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 21 70 131236 - 47 - 0 1-methyl-4-butylcyclohexa-1,3-diene $$ 1-
methyl-4-butyl-5,6-dihydrobenzene $$ 1,3-Cyclohexadiene, 1-butyl-4-methyl- (CAS)
150 C11 H18 0 38903
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 22 70 6932 - 61 - 2 ERYTHRO-1,2-DIPHENYLETHAN-2-D-OL $$ erythro-2-
Deuterio-1,2-diphenylethanol $$ 198 C14 H13 D O
0 93697 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 23 70 85665 - 88 - 9 2-ISOBUTYL-4-METHYL-PYRIDINE $$ Pyridine, 4-
methyl-2-(2-methylpropyl)- (CAS) 2-Isobutyl-4-methylpyridine $$ 149 C10
H15 N 0 37040
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
2 24 70 85665 - 88 - 9 2-Isobutyl-4-methylpyridine $$ 149
C10H15N 0 14286
C:\GCMSsolution\Library\NIST147.LIB
2 25 70 765 - 86 - 6 1,3-Cyclohexadiene, 5,6-dimethyl-, cis- (CAS)
108 C8 H12 0 9203
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
3 1 77 589 - 18 - 4 Benzenemethanol, 4-methyl- (CAS) p-Methylbenzyl
alcohol $$ p-Tolylcarbinol $$ 4-Methylbenzyl alcohol $$ Benzyl alcohol, p-methyl- $
$ 4-(Hydroxymethyl)toluene $$ 4-Methylbenzenemethanol $$ p-Toluyl alcohol $$ 4-
Methyl-1-hydroxymethylbenzene $$ 4-Methyl-benzenemethanol $$ p-Methylbenzylalkohol
$$ 4-Tolylcarbinol $$ 4-Methyl-benzylalcohol $$ 122 C8 H10 O
0 16572 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
3 2 73 115912 - 61 - 3 2-(2-oxoprop-1-yl)cyclohepta-3,5-dien-1-one $$
164 C10 H12 O2 0 52768
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
3 3 71 112239 - 59 - 5 [1-(4'-methylcyclohex-4'-enyl)ethyl] 3,5-
dinitrobenzoate $$ 3-Cyclohexene-1-methanol, .alpha.,4-dimethyl-, 3,5-
dinitrobenzoate, [R-(R*,R*)]- (CAS) 334 C16 H18 N2 O6
0 241671 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
3 4 70 99655 - 45 - 5 2-thia-6-methyl-7-(2-
formylethyl)bicyclo[3.2.0]hept-6-ene-2,2-dioxide $$ 3-Thiabicyclo[3.2.0]hept-6-ene-
6-propanal, 7-methyl-, 3,3-dioxide, (.+-.)- (CAS) 214 C10 H14 O3 S
0 112318 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
3 5 70 0 - 00 - 0 2-CYANO-1-HYDROXY-5-METHYL PYRROLE $$ 122 C6 H6
N2 O 0 15943
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
3 6 70 51532 - 33 - 3 5,9-DIMETHYLSPIRO(3.5)NON-1-ON-5-ENE $$
Spiro[3.5]non-5-en-1-one, 5,9-dimethyl-, trans- (CAS) 164 C11 H16 O
0 53024 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
3 7 70 136587 - 21 - 8 (1RS,8aRS)-1-(3-furyl)-5,8a-dimethyl-
3,4,6,7,8,8a-hexahydro-1H-2-benzopyran-3-one $$ 246 C15 H18 O3
0 152117 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
3 8 69 578 - 58 - 5 Benzene, 1-methoxy-2-methyl- (CAS) o-
Methylanisole $$ 1-METHOXY-2-METHYL-BENZENE $$ 2-Methylanisole $$ o-Methoxytoluene
$$ 2-Methoxytoluene $$ Anisole, o-methyl- $$ Methyl o-tolyl ether $$ o-Cresyl
methyl ether $$ Methyl o-cresyl ether $$ o-Cresol methyl ether $$ 1-Methoxy-2-
methylbenzene $$ Methyl o-methylphenyl ether $$ 2-Methylmethoxybenzene $$ 122
C8 H10 O 0 16585
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
3 9 69 0 - 00 - 0 .ALPHA.-DIDEUTEROBENZYLAMINO-.OMEGA.-BENZYLOXYHEPTANE
$$ 1.alpha.-Dideuterobenzylamino-7-benzyloxyheptane $$ 311 C21 H27 D2 N O
0 221965
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
3 10 69 578 - 58 - 5 Benzene, 1-methoxy-2-methyl- (CAS) o-
Methylanisole $$ 1-METHOXY-2-METHYL-BENZENE $$ 2-Methylanisole $$ o-Methoxytoluene
$$ 2-Methoxytoluene $$ Anisole, o-methyl- $$ Methyl o-tolyl ether $$ o-Cresyl
methyl ether $$ Methyl o-cresyl ether $$ o-Cresol methyl ether $$ 1-Methoxy-2-
methylbenzene $$ Methyl o-methylphenyl ether $$ 2-Methylmethoxybenzene $$ 122
C8 H10 O 0 16582
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
3 11 69 2216 - 45 - 7 4-methylbenzyl acetate $$ Benzenemethanol, 4-
methyl-, acetate (CAS) Benzyl alcohol, p-methyl-, acetate (CAS) p-Methylbenzyl
acetate $$ p-Tolubenzyl acetate $$ p-Xylyl acetate $$ p-Acetoxymethyltoluene $$
164 C10 H12 O2 0 53729
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
3 12 69 3056 - 60 - 8 Phenol, 3-ethyl-, acetate (CAS) m-Ethylphenyl
acetate $$ Phenol, m-ethyl-, acetate $$ 3-Ethylphenyl acetate $$ 3-
(Acetyloxy)ethylbenzene $$ m-Ethylacetoxybenzene $$ 164 C10 H12 O2
0 52652 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
3 13 69 3056 - 60 - 8 Phenol, 3-ethyl-, acetate $$ Phenol, m-ethyl-,
acetate $$ m-Ethylphenyl acetate $$ 3-Ethylphenyl acetate # $$ 164 C10H12O2
0 21138 C:\GCMSsolution\Library\NIST147.LIB
3 14 69 108342 - 25 - 2 (2S,6R,7S,8E)-(+)-2,7-Epoxy-4,8-megastigmadiene
$$ 2,8,8-Trimethyl-7-[(1E)-1-propenyl]-6-oxabicyclo[3.2.1]oct-2-ene # $$ 192
C13H20O 0 35730
C:\GCMSsolution\Library\NIST147.LIB
3 15 69 108342 - 25 - 2 (2s,6r,7s,8e)-(+)-2,7-epoxy-4,8-megastigmadiene
$$ 192 C13 H20 O 0 85094
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
3 16 69 2045 - 79 - 6 2-(2-Methoxyphenyl)ethylamine 151 C9H13NO
0 8708 C:\GCMSsolution\Library\NIST27.LIB
3 17 69 22618 - 23 - 1 Phenol, 3,4-dimethyl-, acetate $$ 3,4-
Dimethylphenyl acetate # $$ 164 C10H12O2 0
21082 C:\GCMSsolution\Library\NIST147.LIB
3 18 69 877 - 82 - 7 Phenol, 3,5-dimethyl-, acetate $$ 3,5-
Dimethylphenyl acetate # $$ 164 C10H12O2 0
21028 C:\GCMSsolution\Library\NIST147.LIB
3 19 69 22618 - 22 - 0 Phenol, 2,3-dimethyl-, acetate $$ 164
C10H12O2 0 21075
C:\GCMSsolution\Library\NIST147.LIB
3 20 68 0 - 00 - 0 .ALPHA.-DIDEUTEROBENZYLAMINO-.OMEGA.-BENZYLOXYHEXANE
$$ 1.alpha.-Dideuterobenzylamino-6-benzyloxyhexane $$ 297 C20 H25 D2 N O
0 208480
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
3 21 68 108 - 68 - 9 Phenol, 3,5-dimethyl- (CAS) 3,5-Xylenol $$ 3,5-
Dimethylphenol $$ 1,3,5-Xylenol $$ 1-Hydroxy-3,5-dimethylbenzene $$ 1,3-Dimethyl-5-
hydroxybenzene $$ 1,5-Dimethyl-3-hyperoxybenzene $$ 3,5-Xylen-1-ol $$ 3,5-Dmp $$
122 C8 H10 O 0 16534
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
3 22 68 877 - 53 - 2 Phenol, 2,4-dimethyl-, acetate $$ 2,4-
Dimethylphenyl acetate # $$ 164 C10H12O2 0
21136 C:\GCMSsolution\Library\NIST147.LIB
3 23 68 60845 - 43 - 4 4-Isopropyl-3,4-dimethylcyclohexa-2,5-dienone $
$ 4-Isopropyl-3,4-dimethyl-2,5-cyclohexadien-1-one # $$ 164 C11H16O
0 21263 C:\GCMSsolution\Library\NIST147.LIB
3 24 68 60845 - 43 - 4 4-ISOPROPYL-3,4-DIMETHYL-CYCLOHEXA-2,5-DIEN-1-
ONE $$ 2,5-Cyclohexadien-1-one, 3,4-dimethyl-4-(1-methylethyl)- (CAS) 4-ISOPROPYL-
3,4-DIMETHYL-CYCLOHEXA-2,5-DIENONE $$ 164 C11 H16 O
0 53850 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
3 25 68 0 - 00 - 0 1,3,4,4a.alpha.,5,6,8,9-Octahydro-4a-hydroxy-6,6,8-
trimethyl-azuleno(5,6-c)furan-3-one $$ 4-Hydroxy-6,6,8-trimethyl-4,4a,5,6,8,9-
hexahydroazuleno[5,6-c]furan-3(1H)-one # $$ 248 C15H20O3
0 66497 C:\GCMSsolution\Library\NIST147.LIB
4 1 85 3691 - 11 - 0 .delta.-Guaiene $$ Azulene, 1,2,3,5,6,7,8,8a-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,7.alpha.,8a.beta.)]-
(CAS) .alpha.-Bulnesene $$ Guaia-1(10),11-diene $$ 204 C15 H24
0 100822 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
4 2 85 3691 - 11 - 0 Azulene, 1,2,3,5,6,7,8,8a-octahydro-1,4-
dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,7.alpha.,8a.beta.)]- 204 C15H24
0 16741
C:\GCMSsolution\Library\NIST27.LIB
4 3 84 3691 - 11 - 0 Azulene, 1,2,3,5,6,7,8,8a-octahydro-1,4-
dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,7.alpha.,8a.beta.)]- 204 C15H24
0 16740
C:\GCMSsolution\Library\NIST27.LIB
4 4 84 3691 - 11 - 0 .delta.-Guaiene $$ Azulene, 1,2,3,5,6,7,8,8a-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,7.alpha.,8a.beta.)]-
(CAS) .alpha.-Bulnesene $$ Guaia-1(10),11-diene $$ .alpha.-Bulnensene $$ DELTA-
GUAJEN (ALPHA-BULNESEN) $$ 204 C15 H24 0
100823 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
4 5 83 3691 - 11 - 0 Azulene, 1,2,3,5,6,7,8,8a-octahydro-1,4-
dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,7.alpha.,8a.beta.)]- $$ Guaia-
1(10),11-diene $$ .alpha.-Bulnesene $$ .delta.-Guaiene $$ 5-Isopropenyl-3,8-
dimethyl-1,2,3,3a,4,5,6,7-octahydroazulene # $$ 204 C15H24
0 42310 C:\GCMSsolution\Library\NIST147.LIB
4 6 83 3691 - 11 - 0 .delta.-Guaiene $$ Azulene, 1,2,3,5,6,7,8,8a-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,7.alpha.,8a.beta.)]-
(CAS) .alpha.-Bulnesene $$ Guaia-1(10),11-diene $$ .alpha.-Bulnensene $$ DELTA-
GUAJEN (ALPHA-BULNESEN) $$ 204 C15 H24 0
100821 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
4 7 81 3691 - 12 - 1 Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-
dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]- $$ Guaia-1(5),11-
diene $$ .alpha.-Guaiene $$ 7-Isopropenyl-1,4-dimethyl-1,2,3,4,5,6,7,8-
octahydroazulene # $$ 204 C15H24 0
42320 C:\GCMSsolution\Library\NIST147.LIB
4 8 81 3691 - 12 - 1 .alpha.-Guaiene $$ Azulene, 1,2,3,4,5,6,7,8-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]-
(CAS) .ALPHA.-GUAIEN $$ Guaia-1(5),11-diene $$ 204 C15 H24
0 100814 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
4 9 80 3691 - 11 - 0 Azulene, 1,2,3,5,6,7,8,8a-octahydro-1,4-
dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,7.alpha.,8a.beta.)]- 204 C15H24
0 16739
C:\GCMSsolution\Library\NIST27.LIB
4 10 80 3691 - 11 - 0 .delta.-Guaiene $$ Azulene, 1,2,3,5,6,7,8,8a-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,7.alpha.,8a.beta.)]-
(CAS) .alpha.-Bulnesene $$ Guaia-1(10),11-diene $$ .alpha.-Bulnensene $$ DELTA-
GUAJEN (ALPHA-BULNESEN) $$ 204 C15 H24 0
100824 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
4 11 80 0 - 00 - 0 1,4-Methanocycloocta[d]pyridazine,
1,4,4a,5,6,9,10,10a-octahydro-11,11-dimethyl-,
(1.alpha.,4.alpha.,4a.alpha.,10a.alpha.)- $$ 204 C13H20N2
0 42139 C:\GCMSsolution\Library\NIST147.LIB
4 12 79 3691 - 12 - 1 .alpha.-Guaiene $$ Azulene, 1,2,3,4,5,6,7,8-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]-
(CAS) .ALPHA.-GUAIEN $$ Guaia-1(5),11-diene $$ ALPHA-GUAIENE $$ ALPHA-GUAIEN $$
Azulene, 1,2,3,4,5,6,7,8-octahydro-7.beta.-isopropenyl-1.beta.,4.beta.-dimeth yl-
(CAS) 204 C15 H24 0 100816
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
4 13 79 3691 - 12 - 1 Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-
dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]- 204 C15H24
0 16754
C:\GCMSsolution\Library\NIST27.LIB
4 14 79 3691 - 12 - 1 .alpha.-Guaiene $$ Azulene, 1,2,3,4,5,6,7,8-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]-
(CAS) .ALPHA.-GUAIEN $$ Guaia-1(5),11-diene $$ ALPHA-GUAIENE $$ ALPHA-GUAIEN $$
Azulene, 1,2,3,4,5,6,7,8-octahydro-7.beta.-isopropenyl-1.beta.,4.beta.-dimeth yl-
(CAS) 204 C15 H24 0 100813
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
4 15 78 515 - 13 - 9 .BETA. ELEMENE $$ 204 C15 H24
0 100278 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
4 16 78 3691 - 12 - 1 .alpha.-Guaiene $$ Azulene, 1,2,3,4,5,6,7,8-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]-
(CAS) .ALPHA.-GUAIEN $$ Guaia-1(5),11-diene $$ ALPHA-GUAIENE $$ ALPHA-GUAIEN $$
Azulene, 1,2,3,4,5,6,7,8-octahydro-7.beta.-isopropenyl-1.beta.,4.beta.-dimeth yl-
(CAS) 204 C15 H24 0 100815
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
4 17 78 3650 - 28 - 0 SATIVEN, (+)- $$ 1,4-Methano-1H-indene,
octahydro-4-methyl-8-methylene-7-(1-methylethyl)-, [1S-
(1.alpha.,3a.beta.,4.alpha.,7.alpha.,7a.beta.)]- (CAS) 1,4-Methanoindan, hexahydro-
7-isopropyl-4-methyl-8-methylene-, (+)- $$ (+)-Sativene $$ Sativene, (+)- $$ 1,4-
Methanoindan, hexahydro-7-isopropyl-4-methyl-8-methylene- $$ 204 C15 H24
0 100801
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
4 18 78 3650 - 28 - 0 1,4-Methano-1H-indene, octahydro-4-methyl-8-
methylene-7-(1-methylethyl)-, [1S-(1.alpha.,3a.beta.,4.alpha.,7.alpha.,7a.beta.)]-
$$ (+)-Sativen $$ 1,4-Methanoindan, hexahydro-7-isopropyl-4-methyl-8-methylene-,
(+)- $$ (+)-Sativene $$ Sativene, (+)- $$ 1,4-Methanoindan, hexahydro-7-isopropyl-
4-methyl-8-methylene- $$ 204 C15H24 0
42380 C:\GCMSsolution\Library\NIST147.LIB
4 19 77 22567 - 17 - 5 .gamma.-Gurjunene $$ Azulene, 1,2,3,3a,4,5,6,7-
octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1R-
(1.alpha.,3a.beta.,4.alpha.,7.beta.)]- (CAS) 1.beta.,4.beta.H,10.beta.H-Guaia-5,11-
diene $$ GAMMA-GURJUNENE $$ .gamma. gurjunene $$ 5,6,11,11-
tetramethyltricyclo[5.4.0(5,10).0(3,4)]undec-9-ene $$ (+)-GAMMA-GURJUNEN $$
204 C15 H24 0 100811
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
4 20 77 515 - 13 - 9 .beta.-elemene $$ 204 C15 H24
0 101098 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
4 21 77 3691 - 12 - 1 Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-
dimethyl-7-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,7.alpha.)]- 204 C15H24
0 16755
C:\GCMSsolution\Library\NIST27.LIB
4 22 77 473 - 13 - 2 Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-4a,8-
dimethyl-2-(1-methylethenyl)-, [2R-(2.alpha.,4a.alpha.,8a.beta.)]- $$ .alpha.-
Selinene $$ 2-Isopropenyl-4a,8-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene # $
$ 204 C15H24 0 42274
C:\GCMSsolution\Library\NIST147.LIB
4 23 77 18431 - 82 - 8 .beta.-Chamigrene $$ Spiro[5.5]undec-2-ene,
3,7,7-trimethyl-11-methylene-, (-)- (CAS) Spiro[5.5]undec-2-ene, 3,7,7-trimethyl-
11-methylene-, (R)- (CAS) Chamigren $$ Chamigrene $$ BETA-CHAMIGRENE $$ BETA-
CHAMIGREN $$ 204 C15 H24 0 100767
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
4 24 77 0 - 00 - 0 Cycloheptane, 4-methylene-1-methyl-2-(2-methyl-1-
propen-1-yl)-1-vinyl- $$ 1-Methyl-4-methylene-2-(2-methyl-1-propenyl)-1-
vinylcycloheptane # $$ 204 C15H24 0
42226 C:\GCMSsolution\Library\NIST147.LIB
4 25 77 0 - 00 - 0 CYCLOHEPTAN, 4-METHYLEN-1-METHYL-2-(2-METHYL-1-
PROPEN-1-YL)-1-VINYL- (HUMULEN-"V $$ 204 C15 H24
0 100352 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 1 87 5986 - 55 - 0 Patchouli alcohol $$ 1,6-Methanonaphthalen-
1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, [1R-
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)]- (CAS) 1,6-Methanonaphthalen-1(2H)-
ol, octahydro-4,8a,9,9-tetramethyl-,
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)- (CAS) Patchoulol $$ Patchoulic
alcohol $$ 1,6-Methanonaphthalen-1.beta.(2H)-ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-
octahydro-4.alpha.,8a.beta.,9,9-tetrame thyl- $$ 1,6-Methanonaphthalen-1.beta.(2H)-
ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-octahydro-4.alpha.,8a.beta 222 C15 H26 O
0 124011
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 2 86 5986 - 55 - 0 Patchouli alcohol $$ 1,6-Methanonaphthalen-
1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, [1R-
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)]- (CAS) 1,6-Methanonaphthalen-1(2H)-
ol, octahydro-4,8a,9,9-tetramethyl-,
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)- (CAS) Patchoulol $$ Patchoulic
alcohol $$ 1,6-Methanonaphthalen-1.beta.(2H)-ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-
octahydro-4.alpha.,8a.beta.,9,9-tetrame thyl- $$ 1,6-Methanonaphthalen-1.beta.(2H)-
ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-octahydro-4.alpha.,8a.beta 222 C15 H26 O
0 124013
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 3 86 5986 - 55 - 0 Patchouli alcohol $$ 1,6-Methanonaphthalen-
1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, [1R-
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)]- (CAS) 1,6-Methanonaphthalen-1(2H)-
ol, octahydro-4,8a,9,9-tetramethyl-,
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)- (CAS) Patchoulol $$ Patchoulic
alcohol $$ 1,6-Methanonaphthalen-1.beta.(2H)-ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-
octahydro-4.alpha.,8a.beta.,9,9-tetrame thyl- $$ 1,6-Methanonaphthalen-1.beta.(2H)-
ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-octahydro-4.alpha.,8a.beta 222 C15 H26 O
0 124014
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 4 86 5986 - 55 - 0 Patchouli alcohol 222 C15H26O
0 18688 C:\GCMSsolution\Library\NIST27.LIB
5 5 84 5986 - 55 - 0 Patchouli alcohol $$ 1,6-Methanonaphthalen-
1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, [1R-
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)]- (CAS) 1,6-Methanonaphthalen-1(2H)-
ol, octahydro-4,8a,9,9-tetramethyl-,
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)- (CAS) Patchoulol $$ Patchoulic
alcohol $$ 1,6-Methanonaphthalen-1.beta.(2H)-ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-
octahydro-4.alpha.,8a.beta.,9,9-tetrame thyl- $$ 1,6-Methanonaphthalen-1.beta.(2H)-
ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-octahydro-4.alpha.,8a.beta 222 C15 H26 O
0 124018
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 6 82 5986 - 55 - 0 Patchouli alcohol $$ 1,6-Methanonaphthalen-
1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, [1R-
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)]- $$ 1,6-Methanonaphthalen-1.beta.
(2H)-ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-octahydro-4.alpha.,8a.beta.,9,9-tetramethyl-
$$ Patchoulic alcohol $$ Patchoulol $$ 1,6-Methanonaphthalen-1(2H)-ol, octahydro-
4,8a,9,9-tetramethyl-, (1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)- $$ 222
C15H26O 0 52578
C:\GCMSsolution\Library\NIST147.LIB
5 7 82 5986 - 55 - 0 Patchouli alcohol $$ 1,6-Methanonaphthalen-
1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, [1R-
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)]- (CAS) 1,6-Methanonaphthalen-1(2H)-
ol, octahydro-4,8a,9,9-tetramethyl-,
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)- (CAS) Patchoulol $$ Patchoulic
alcohol $$ 1,6-Methanonaphthalen-1.beta.(2H)-ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-
octahydro-4.alpha.,8a.beta.,9,9-tetrame thyl- $$ 1,6-Methanonaphthalen-1.beta.(2H)-
ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-octahydro-4.alpha.,8a.beta 222 C15 H26 O
0 124012
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 8 82 5986 - 55 - 0 Patchouli alcohol 222 C15H26O
0 18687 C:\GCMSsolution\Library\NIST27.LIB
5 9 80 5986 - 55 - 0 Patchouli alcohol $$ 1,6-Methanonaphthalen-
1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, [1R-
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)]- (CAS) 1,6-Methanonaphthalen-1(2H)-
ol, octahydro-4,8a,9,9-tetramethyl-,
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)- (CAS) Patchoulol $$ Patchoulic
alcohol $$ 1,6-Methanonaphthalen-1.beta.(2H)-ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-
octahydro-4.alpha.,8a.beta.,9,9-tetrame thyl- $$ 1,6-Methanonaphthalen-1.beta.(2H)-
ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-octahydro-4.alpha.,8a.beta 222 C15 H26 O
0 124016
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 10 79 5986 - 49 - 2 4aH-Cycloprop[e]azulen-4a-ol, decahydro-
1,1,4,7-tetramethyl-, [1aR-
(1a.alpha.,4.beta.,4a.beta.,7.alpha.,7a.beta.,7b.alpha.)]- $$ Palustrol $$
Palustrol (Ledum) $$ 4aH-Cycloprop[e]azulen-4a-ol, decahydro-1,1,4,7-tetramethyl- $
$ Diepi-palustrol $$ 1,1,4,7-Tetramethyldecahydro-4ah-cyclopropa[e]azulen-4a-ol #
$$ 222 C15H26O 0 52557
C:\GCMSsolution\Library\NIST147.LIB
5 11 79 0 - 00 - 0 DIEPIPALUSTROL $$ 222 C15 H26 O
0 123227 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
5 12 79 5986 - 55 - 0 Patchouli alcohol $$ 1,6-Methanonaphthalen-
1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, [1R-
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)]- (CAS) 1,6-Methanonaphthalen-1(2H)-
ol, octahydro-4,8a,9,9-tetramethyl-,
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)- (CAS) Patchoulol $$ Patchoulic
alcohol $$ 1,6-Methanonaphthalen-1.beta.(2H)-ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-
octahydro-4.alpha.,8a.beta.,9,9-tetrame thyl- $$ 1,6-Methanonaphthalen-1.beta.(2H)-
ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-octahydro-4.alpha.,8a.beta 222 C15 H26 O
0 124017
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 13 79 5986 - 55 - 0 Patchouli alcohol $$ 1,6-Methanonaphthalen-
1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, [1R-
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)]- (CAS) 1,6-Methanonaphthalen-1(2H)-
ol, octahydro-4,8a,9,9-tetramethyl-,
(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)- (CAS) Patchoulol $$ Patchoulic
alcohol $$ 1,6-Methanonaphthalen-1.beta.(2H)-ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-
octahydro-4.alpha.,8a.beta.,9,9-tetrame thyl- $$ 1,6-Methanonaphthalen-1.beta.(2H)-
ol, 3,4,4a.beta.,5,6.beta.,7,8,8a-octahydro-4.alpha.,8a.beta 222 C15 H26 O
0 124015
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 14 77 577 - 27 - 5 Ledol $$ 1H-Cycloprop[e]azulen-4-ol, decahydro-
1,1,4,7-tetramethyl-, [1ar-
(1a.alpha.,4.alpha.,4a.beta.,7.alpha.,7a.beta.,7b.alpha.)]- $$ 1H-
Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, (1ar,4R,4as,7R,7as,7bs)- $
$ (+)-Ledol $$ d-Ledol $$ 1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-
tetramethyl-, [1ar-(1a.alpha.,4.alpha.,4a.beta.,7.beta.,7a.beta.,7b.alpha.)]- $$
1,1,4,7-Tetramethyldecahydro-1H-cyclopropa[e]azulen-4-ol # $$ 222 C15H26O
0 52581 C:\GCMSsolution\Library\NIST147.LIB
5 15 77 577 - 27 - 5 1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-
tetramethyl-, [1ar-(1a.alpha.,4.alpha.,4a.beta.,7.alpha.,7a.beta.,7b.alpha.)]-
(CAS) Ledol $$ d-Ledol $$ (+)-Ledol $$ 1H-Cycloprop[e]azulen-4-ol, decahydro-
1,1,4,7-tetramethyl-, (1ar,4R,4as,7R,7as,7bs)- $$ 1H-Cycloprop[e]azulen-4-ol,
decahydro-1,1,4,7-tetramethyl-, [1ar-
(1a.alpha.,4.alpha.,4a.beta.,7.beta.,7a.beta.,7b.alpha.)]- $$ 222 C15 H26 O
0 124068
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 16 76 0 - 00 - 0 Cycloheptane, 4-methylene-1-methyl-2-(2-methyl-1-
propen-1-yl)-1-vinyl- $$ 1-Methyl-4-methylene-2-(2-methyl-1-propenyl)-1-
vinylcycloheptane # $$ 204 C15H24 0
42226 C:\GCMSsolution\Library\NIST147.LIB
5 17 76 0 - 00 - 0 CYCLOHEPTAN, 4-METHYLEN-1-METHYL-2-(2-METHYL-1-
PROPEN-1-YL)-1-VINYL- (HUMULEN-"V $$ 204 C15 H24
0 100352 C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 18 76 25826 - 85 - 1 5.BETA.,7.BETA.H,10.ALPHA.-EUDESM-11-EN-
1.ALPHA.-OL $$ 2-BENZYL-7-ISOPROPYL-10-METHYL-1,5-DITHIA-SPIRO[5.5]UNDECANE 1-OXIDE
$$ 222 C15 H26 O 0 124109
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 19 76 25826 - 85 - 1 5.beta.,7.beta.H,10.alpha.-Eudesm-11-en-
1.alpha.-ol 222 C15H26O 0 18653
C:\GCMSsolution\Library\NIST27.LIB
5 20 76 105794 - 58 - 9 1-Heptatriacotanol $$ 1-Heptatriacontanol # $$
536 C37H76O 0 143029
C:\GCMSsolution\Library\NIST147.LIB
5 21 76 5986 - 49 - 2 Palustrol $$ 4aH-Cycloprop[e]azulen-4a-ol,
decahydro-1,1,4,7-tetramethyl-, [1aR-
(1a.alpha.,4.beta.,4a.beta.,7.alpha.,7a.beta.,7b.alpha.)]- (CAS) Palustrol (Ledum)
$$ 4aH-Cycloprop[e]azulen-4a-ol, decahydro-1,1,4,7-tetramethyl- $$ 222 C15
H26 O 0 124075
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 22 75 5986 - 49 - 2 Palustrol $$ 4aH-Cycloprop[e]azulen-4a-ol,
decahydro-1,1,4,7-tetramethyl-, [1aR-
(1a.alpha.,4.beta.,4a.beta.,7.alpha.,7a.beta.,7b.alpha.)]- (CAS) Palustrol (Ledum)
$$ 4aH-Cycloprop[e]azulen-4a-ol, decahydro-1,1,4,7-tetramethyl- $$ 222 C15
H26 O 0 124074
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
5 23 75 95975 - 84 - 1 4aH-cycloprop[e]azulen-4a-ol, decahydro-
1,1,4,7-tetramethyl- $$ 1,1,4,7-Tetramethyldecahydro-4ah-cyclopropa[e]azulen-4a-ol
# $$ 222 C15H26O 0 52549
C:\GCMSsolution\Library\NIST147.LIB
5 24 75 0 - 00 - 0 sesquisabinene hydrate $$ 222 C15 H26 O
0 123255 C:\GCMSsolution\Library\Willey 7th
Edition\WILEY7.LIB
5 25 75 465 - 24 - 7 LONGIBORNEOL $$ 1,4-METHANOAZULEN-9-OL,
DECAHYDRO-1,5,5,8A-TETRAMETHYL-, [1R-(1.ALPHA.,3A.BETA., $$ 222 C15 H26 O
0 123983
C:\GCMSsolution\Library\Willey 7th Edition\WILEY7.LIB
[MS Chromatogram]
m/z 1-1 TIC
Event Time(msec) 500
# of Points 3120
Start Time(min) 3.000
End Time(min) 28.992
Ret.Time Absolute Intensity Relative Intensity
3.000 8941 8.99
3.008 8743 8.79
3.017 8654 8.70
3.025 8714 8.76
3.033 8793 8.84
3.042 8829 8.87
3.050 8763 8.81
3.058 8613 8.66
3.067 7524 7.56
3.075 7607 7.65
3.083 7606 7.64
3.092 7578 7.62
3.100 7603 7.64
3.108 8566 8.61
3.117 8425 8.47
3.125 7328 7.36
3.133 7267 7.30
3.142 7266 7.30
3.150 7329 7.37
3.158 7321 7.36
3.167 7283 7.32
3.175 7264 7.30
3.183 7274 7.31
3.192 7292 7.33
3.200 7288 7.32
3.208 7335 7.37
3.217 7340 7.38
3.225 7309 7.35
3.233 7274 7.31
3.242 7191 7.23
3.250 7168 7.20
3.258 7237 7.27
3.267 7240 7.28
3.275 7161 7.20
3.283 7092 7.13
3.292 7086 7.12
3.300 7147 7.18
3.308 7104 7.14
3.317 6995 7.03
3.325 7005 7.04
3.333 7122 7.16
3.342 7179 7.22
3.350 7126 7.16
3.358 7058 7.09
3.367 7001 7.04
3.375 7016 7.05
3.383 7087 7.12
3.392 7180 7.22
3.400 7158 7.19
3.408 7027 7.06
3.417 6999 7.03
3.425 7054 7.09
3.433 7046 7.08
3.442 7024 7.06
3.450 7030 7.07
3.458 6999 7.03
3.467 6860 6.89
3.475 6820 6.85
3.483 6865 6.90
3.492 6857 6.89
3.500 6870 6.90
3.508 6848 6.88
3.517 6844 6.88
3.525 6849 6.88
3.533 6886 6.92
3.542 6979 7.01
3.550 6966 7.00
3.558 6912 6.95
3.567 6842 6.88
3.575 6793 6.83
3.583 6768 6.80
3.592 6763 6.80
3.600 6841 6.88
3.608 6825 6.86
3.617 6667 6.70
3.625 6560 6.59
3.633 6604 6.64
3.642 6673 6.71
3.650 6673 6.71
3.658 6617 6.65
3.667 6562 6.60
3.675 6612 6.65
3.683 6691 6.72
3.692 6636 6.67
3.700 6518 6.55
3.708 6546 6.58
3.717 6608 6.64
3.725 6583 6.62
3.733 6566 6.60
3.742 6610 6.64
3.750 6672 6.71
3.758 6657 6.69
3.767 6587 6.62
3.775 6564 6.60
3.783 6604 6.64
3.792 6589 6.62
3.800 6592 6.63
3.808 6613 6.65
3.817 6544 6.58
3.825 6562 6.60
3.833 6644 6.68
3.842 6583 6.62
3.850 6439 6.47
3.858 6449 6.48
3.867 6528 6.56
3.875 6477 6.51
3.883 6508 6.54
3.892 6643 6.68
3.900 6639 6.67
3.908 6532 6.56
3.917 6489 6.52
3.925 6523 6.56
3.933 6519 6.55
3.942 6415 6.45
3.950 6308 6.34
3.958 6343 6.38
3.967 6333 6.36
3.975 6281 6.31
3.983 6381 6.41
3.992 6478 6.51
4.000 6430 6.46
4.008 6333 6.36
4.017 6323 6.35
4.025 6372 6.40
4.033 6350 6.38
4.042 6378 6.41
4.050 6479 6.51
4.058 6411 6.44
4.067 6321 6.35
4.075 6374 6.41
4.083 6366 6.40
4.092 6303 6.33
4.100 6367 6.40
4.108 6432 6.46
4.117 6379 6.41
4.125 6328 6.36
4.133 6367 6.40
4.142 6378 6.41
4.150 6348 6.38
4.158 6364 6.40
4.167 6340 6.37
4.175 6334 6.37
4.183 6394 6.43
4.192 6385 6.42
4.200 6351 6.38
4.208 6316 6.35
4.217 6309 6.34
4.225 6363 6.40
4.233 6396 6.43
4.242 6307 6.34
4.250 6191 6.22
4.258 6163 6.19
4.267 6231 6.26
4.275 6355 6.39
4.283 6403 6.44
4.292 6364 6.40
4.300 6315 6.35
4.308 6218 6.25
4.317 6154 6.19
4.325 6214 6.25
4.333 6283 6.31
4.342 6330 6.36
4.350 6350 6.38
4.358 6296 6.33
4.367 6200 6.23
4.375 6154 6.19
4.383 6169 6.20
4.392 6221 6.25
4.400 6280 6.31
4.408 6225 6.26
4.417 6172 6.20
4.425 6185 6.22
4.433 6161 6.19
4.442 6142 6.17
4.450 6117 6.15
4.458 6103 6.13
4.467 6166 6.20
4.475 6220 6.25
4.483 6233 6.26
4.492 6197 6.23
4.500 6196 6.23
4.508 6270 6.30
4.517 6284 6.32
4.525 6210 6.24
4.533 6140 6.17
4.542 6197 6.23
4.550 6315 6.35
4.558 6342 6.37
4.567 6334 6.37
4.575 6320 6.35
4.583 6298 6.33
4.592 6260 6.29
4.600 6229 6.26
4.608 6171 6.20
4.617 6146 6.18
4.625 6222 6.25
4.633 6223 6.25
4.642 6179 6.21
4.650 6258 6.29
4.658 6353 6.39
4.667 6419 6.45
4.675 6311 6.34
4.683 6200 6.23
4.692 6301 6.33
4.700 6370 6.40
4.708 6331 6.36
4.717 6282 6.31
4.725 6254 6.29
4.733 6277 6.31
4.742 6248 6.28
4.750 6183 6.21
4.758 6182 6.21
4.767 6124 6.15
4.775 6118 6.15
4.783 6292 6.32
4.792 6320 6.35
4.800 6213 6.24
4.808 6257 6.29
4.817 6341 6.37
4.825 6306 6.34
4.833 6192 6.22
4.842 6051 6.08
4.850 5983 6.01
4.858 6042 6.07
4.867 6120 6.15
4.875 6189 6.22
4.883 6212 6.24
4.892 6141 6.17
4.900 6139 6.17
4.908 6174 6.21
4.917 6144 6.17
4.925 6129 6.16
4.933 6208 6.24
4.942 6132 6.16
4.950 5969 6.00
4.958 6064 6.09
4.967 6154 6.19
4.975 6159 6.19
4.983 6206 6.24
4.992 6196 6.23
5.000 6159 6.19
5.008 6101 6.13
5.017 6074 6.10
5.025 6170 6.20
5.033 6253 6.28
5.042 6169 6.20
5.050 6100 6.13
5.058 6206 6.24
5.067 6236 6.27
5.075 6093 6.12
5.083 5967 6.00
5.092 5922 5.95
5.100 5975 6.01
5.108 6014 6.04
5.117 6012 6.04
5.125 6105 6.14
5.133 6198 6.23
5.142 6202 6.23
5.150 6167 6.20
5.158 6078 6.11
5.167 6065 6.10
5.175 6129 6.16
5.183 6084 6.11
5.192 6008 6.04
5.200 5986 6.02
5.208 6004 6.03
5.217 6122 6.15
5.225 6184 6.22
5.233 6164 6.20
5.242 6174 6.21
5.250 6153 6.18
5.258 6129 6.16
5.267 6154 6.19
5.275 6190 6.22
5.283 6253 6.28
5.292 6308 6.34
5.300 6265 6.30
5.308 6132 6.16
5.317 6071 6.10
5.325 6133 6.16
5.333 6238 6.27
5.342 6224 6.26
5.350 6139 6.17
5.358 6135 6.17
5.367 5079 5.10
5.375 5061 5.09
5.383 5177 5.20
5.392 5230 5.26
5.400 5161 5.19
5.408 5089 5.11
5.417 6097 6.13
5.425 6061 6.09
5.433 5982 6.01
5.442 5018 5.04
5.450 5094 5.12
5.458 5133 5.16
5.467 5074 5.10
5.475 4952 4.98
5.483 4944 4.97
5.492 5024 5.05
5.500 5085 5.11
5.508 5062 5.09
5.517 5046 5.07
5.525 5028 5.05
5.533 5014 5.04
5.542 5072 5.10
5.550 5103 5.13
5.558 5065 5.09
5.567 5077 5.10
5.575 5140 5.17
5.583 5130 5.16
5.592 5101 5.13
5.600 5146 5.17
5.608 5169 5.20
5.617 5123 5.15
5.625 5106 5.13
5.633 5110 5.14
5.642 5117 5.14
5.650 5206 5.23
5.658 5240 5.27
5.667 5144 5.17
5.675 5096 5.12
5.683 5164 5.19
5.692 5247 5.27
5.700 5250 5.28
5.708 5177 5.20
5.717 5121 5.15
5.725 5123 5.15
5.733 5091 5.12
5.742 5113 5.14
5.750 5241 5.27
5.758 5283 5.31
5.767 5240 5.27
5.775 5226 5.25
5.783 5224 5.25
5.792 5196 5.22
5.800 5207 5.23
5.808 5214 5.24
5.817 5213 5.24
5.825 5194 5.22
5.833 5110 5.14
5.842 5055 5.08
5.850 5102 5.13
5.858 5120 5.15
5.867 5052 5.08
5.875 5057 5.08
5.883 5129 5.15
5.892 5145 5.17
5.900 5113 5.14
5.908 5069 5.09
5.917 5141 5.17
5.925 5170 5.20
5.933 5046 5.07
5.942 4994 5.02
5.950 5074 5.10
5.958 5184 5.21
5.967 5213 5.24
5.975 5153 5.18
5.983 5104 5.13
5.992 5094 5.12
6.000 5114 5.14
6.008 5125 5.15
6.017 5124 5.15
6.025 5150 5.18
6.033 5166 5.19
6.042 5115 5.14
6.050 5077 5.10
6.058 5070 5.10
6.067 5010 5.04
6.075 5011 5.04
6.083 5084 5.11
6.092 5095 5.12
6.100 5080 5.11
6.108 5021 5.05
6.117 5014 5.04
6.125 5101 5.13
6.133 5104 5.13
6.142 5077 5.10
6.150 5114 5.14
6.158 5133 5.16
6.167 5114 5.14
6.175 5119 5.14
6.183 5155 5.18
6.192 5222 5.25
6.200 5270 5.30
6.208 5181 5.21
6.217 5073 5.10
6.225 5069 5.09
6.233 5118 5.14
6.242 5173 5.20
6.250 5175 5.20
6.258 5172 5.20
6.267 5182 5.21
6.275 5162 5.19
6.283 5131 5.16
6.292 5105 5.13
6.300 5093 5.12
6.308 5133 5.16
6.317 5129 5.15
6.325 5054 5.08
6.333 5070 5.10
6.342 5183 5.21
6.350 5200 5.23
6.358 5111 5.14
6.367 5093 5.12
6.375 5174 5.20
6.383 5201 5.23
6.392 5179 5.21
6.400 5172 5.20
6.408 5160 5.19
6.417 5171 5.20
6.425 5140 5.17
6.433 5112 5.14
6.442 5111 5.14
6.450 4993 5.02
6.458 4983 5.01
6.467 5155 5.18
6.475 5224 5.25
6.483 5135 5.16
6.492 5070 5.10
6.500 5082 5.11
6.508 5098 5.12
6.517 5108 5.13
6.525 5175 5.20
6.533 5245 5.27
6.542 5193 5.22
6.550 5078 5.10
6.558 5049 5.07
6.567 5133 5.16
6.575 5210 5.24
6.583 5181 5.21
6.592 5169 5.20
6.600 5258 5.28
6.608 5282 5.31
6.617 5176 5.20
6.625 5146 5.17
6.633 5170 5.20
6.642 5123 5.15
6.650 5120 5.15
6.658 5130 5.16
6.667 5155 5.18
6.675 5289 5.32
6.683 5319 5.35
6.692 5194 5.22
6.700 5130 5.16
6.708 5159 5.19
6.717 5203 5.23
6.725 5185 5.21
6.733 5127 5.15
6.742 5114 5.14
6.750 5164 5.19
6.758 5236 5.26
6.767 5279 5.31
6.775 5243 5.27
6.783 5238 5.26
6.792 5272 5.30
6.800 5235 5.26
6.808 5162 5.19
6.817 5114 5.14
6.825 5135 5.16
6.833 5172 5.20
6.842 5134 5.16
6.850 5118 5.14
6.858 5200 5.23
6.867 5238 5.26
6.875 5194 5.22
6.883 5203 5.23
6.892 5260 5.29
6.900 5239 5.27
6.908 5175 5.20
6.917 5205 5.23
6.925 5310 5.34
6.933 5246 5.27
6.942 5073 5.10
6.950 5067 5.09
6.958 5161 5.19
6.967 5186 5.21
6.975 5149 5.17
6.983 5142 5.17
6.992 5223 5.25
7.000 5242 5.27
7.008 5147 5.17
7.017 5101 5.13
7.025 5121 5.15
7.033 5085 5.11
7.042 5149 5.17
7.050 5267 5.29
7.058 5186 5.21
7.067 5094 5.12
7.075 5172 5.20
7.083 5239 5.27
7.092 5199 5.23
7.100 5232 5.26
7.108 5279 5.31
7.117 5224 5.25
7.125 5192 5.22
7.133 5216 5.24
7.142 5229 5.26
7.150 5225 5.25
7.158 5187 5.21
7.167 5147 5.17
7.175 5164 5.19
7.183 5200 5.23
7.192 5280 5.31
7.200 5256 5.28
7.208 5196 5.22
7.217 5256 5.28
7.225 5301 5.33
7.233 5271 5.30
7.242 5222 5.25
7.250 5229 5.26
7.258 5264 5.29
7.267 5246 5.27
7.275 5204 5.23
7.283 6284 6.32
7.292 13189 13.26
7.300 21097 21.20
7.308 27868 28.01
7.317 27106 27.24
7.325 19458 19.56
7.333 15685 15.76
7.342 7847 7.89
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27.617 7797 7.84
27.625 7795 7.83
27.633 7716 7.75
27.642 7679 7.72
27.650 7706 7.74
27.658 7705 7.74
27.667 7686 7.72
27.675 7736 7.78
27.683 7716 7.75
27.692 7650 7.69
27.700 7699 7.74
27.708 7695 7.73
27.717 7648 7.69
27.725 7658 7.70
27.733 7753 7.79
27.742 7873 7.91
27.750 7820 7.86
27.758 7729 7.77
27.767 7792 7.83
27.775 7792 7.83
27.783 7689 7.73
27.792 7678 7.72
27.800 7796 7.84
27.808 7890 7.93
27.817 7858 7.90
27.825 7835 7.87
27.833 7839 7.88
27.842 7820 7.86
27.850 7819 7.86
27.858 7781 7.82
27.867 7742 7.78
27.875 7823 7.86
27.883 7920 7.96
27.892 7796 7.84
27.900 7686 7.72
27.908 7758 7.80
27.917 7875 7.91
27.925 7843 7.88
27.933 7754 7.79
27.942 7804 7.84
27.950 7882 7.92
27.958 7895 7.93
27.967 7884 7.92
27.975 7878 7.92
27.983 7836 7.88
27.992 7738 7.78
28.000 7730 7.77
28.008 7780 7.82
28.017 7777 7.82
28.025 7736 7.78
28.033 7771 7.81
28.042 7858 7.90
28.050 7864 7.90
28.058 7770 7.81
28.067 7697 7.74
28.075 7726 7.76
28.083 7689 7.73
28.092 7606 7.64
28.100 7574 7.61
28.108 7573 7.61
28.117 7692 7.73
28.125 7808 7.85
28.133 7767 7.81
28.142 7724 7.76
28.150 7789 7.83
28.158 7878 7.92
28.167 7847 7.89
28.175 7751 7.79
28.183 7813 7.85
28.192 7893 7.93
28.200 7837 7.88
28.208 7793 7.83
28.217 7798 7.84
28.225 7804 7.84
28.233 7802 7.84
28.242 7789 7.83
28.250 7859 7.90
28.258 7962 8.00
28.267 7943 7.98
28.275 7812 7.85
28.283 7776 7.82
28.292 7853 7.89
28.300 7813 7.85
28.308 7710 7.75
28.317 7745 7.78
28.325 7836 7.88
28.333 7788 7.83
28.342 7776 7.82
28.350 7795 7.83
28.358 7728 7.77
28.367 7805 7.84
28.375 7885 7.92
28.383 7827 7.87
28.392 7803 7.84
28.400 7771 7.81
28.408 7713 7.75
28.417 7723 7.76
28.425 7812 7.85
28.433 7867 7.91
28.442 7831 7.87
28.450 7733 7.77
28.458 7693 7.73
28.467 7764 7.80
28.475 7813 7.85
28.483 7795 7.83
28.492 7736 7.78
28.500 7788 7.83
28.508 7852 7.89
28.517 7728 7.77
28.525 7751 7.79
28.533 7923 7.96
28.542 7926 7.97
28.550 7873 7.91
28.558 7868 7.91
28.567 7851 7.89
28.575 7809 7.85
28.583 7811 7.85
28.592 7866 7.91
28.600 7872 7.91
28.608 7860 7.90
28.617 7884 7.92
28.625 7823 7.86
28.633 7764 7.80
28.642 7833 7.87
28.650 7844 7.88
28.658 7836 7.88
28.667 7851 7.89
28.675 7795 7.83
28.683 7758 7.80
28.692 7742 7.78
28.700 7731 7.77
28.708 7796 7.84
28.717 7820 7.86
28.725 7768 7.81
28.733 7766 7.81
28.742 7791 7.83
28.750 7777 7.82
28.758 7770 7.81
28.767 7829 7.87
28.775 7880 7.92
28.783 7886 7.93
28.792 7850 7.89
28.800 7857 7.90
28.808 7882 7.92
28.817 7840 7.88
28.825 7810 7.85
28.833 7814 7.85
28.842 7861 7.90
28.850 7912 7.95
28.858 7858 7.90
28.867 7878 7.92
28.875 7949 7.99
28.883 7957 8.00
28.892 7978 8.02
28.900 7960 8.00
28.908 7789 7.83
28.917 7623 7.66
28.925 7657 7.70
28.933 7735 7.77
28.942 7704 7.74
28.950 7713 7.75
28.958 7817 7.86
28.967 7861 7.90
28.975 7908 7.95
28.983 7948 7.99
28.992 7879 7.92

[MS Spectrum]
# of Peaks 16
Raw Spectrum 7.308 (scan : 518) Base Peak m/z 105.10 (Inten : 3,015)
Background 7.258 (scan : 512)
m/z Absolute Intensity Relative Intensity
39.95 63 2.09
41.05 1436 47.63
44.00 18 0.60
55.05 1174 38.94
67.05 1068 35.42
77.05 1093 36.25
79.05 1870 62.02
81.10 1454 48.23
91.05 1800 59.70
93.10 1911 63.38
105.10 3015 100.00
107.10 2121 70.35
119.10 1070 35.49
133.15 1405 46.60
147.15 1994 66.14
148.15 1112 36.88
[MS Spectrum]
# of Peaks 4
Raw Spectrum 8.225 (scan : 628) Base Peak m/z 107.10 (Inten : 1,284)
Background 8.200 (scan : 625)
m/z Absolute Intensity Relative Intensity
39.95 62 4.83
44.00 56 4.36
93.10 1241 96.65
107.10 1284 100.00
[MS Spectrum]
# of Peaks 6
Raw Spectrum 8.325 (scan : 640) Base Peak m/z 122.15 (Inten : 2,393)
Background 8.383 (scan : 647)
m/z Absolute Intensity Relative Intensity
39.95 49 2.05
91.05 1020 42.62
93.10 1052 43.96
105.10 1025 42.83
107.15 1133 47.35
122.15 2393 100.00
[MS Spectrum]
# of Peaks 22
Raw Spectrum 9.742 (scan : 810) Base Peak m/z 107.10 (Inten : 4,130)
Background 9.692 (scan : 804)
m/z Absolute Intensity Relative Intensity
39.95 191 4.62
41.00 2009 48.64
53.05 1024 24.79
55.05 1557 37.70
67.05 1410 34.14
77.05 1665 40.31
79.05 2706 65.52
81.10 1908 46.20
91.05 2505 60.65
93.10 3780 91.53
95.10 1586 38.40
105.10 2854 69.10
106.10 1028 24.89
107.10 4130 100.00
108.10 3305 80.02
109.10 1014 24.55
119.10 1545 37.41
121.15 1063 25.74
133.10 1386 33.56
147.20 1207 29.23
148.15 1149 27.82
189.15 1336 32.35
[MS Spectrum]
# of Peaks 38
Raw Spectrum 20.142 (scan : 2058) Base Peak m/z 41.05 (Inten : 5,183)
Background 20.067 (scan : 2049)
m/z Absolute Intensity Relative Intensity
39.95 307 5.92
41.05 5183 100.00
43.05 4667 90.04
44.00 294 5.67
53.00 1518 29.29
55.05 3953 76.27
67.05 3167 61.10
69.05 2954 56.99
77.05 2105 40.61
79.05 2903 56.01
81.10 4585 88.46
82.10 1678 32.38
83.10 4564 88.06
84.05 1136 21.92
91.05 2964 57.19
93.10 3838 74.05
94.10 1156 22.30
95.10 2847 54.93
97.10 1020 19.68
98.10 3788 73.09
105.10 3670 70.81
107.10 3938 75.98
108.10 1671 32.24
109.10 2377 45.86
111.10 1551 29.92
119.10 2385 46.02
121.15 2077 40.07
123.15 1378 26.59
125.15 2301 44.40
133.15 1512 29.17
135.15 1425 27.49
138.15 4352 83.97
147.15 1209 23.33
161.20 3074 59.31
189.20 1494 28.83
204.20 1122 21.65
207.20 1002 19.33
222.20 2550 49.20

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