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trans-1,1-Dimethyl-3-((phenylthio)methyl)-4-(2-propenyl)cyclohexane
SpectraBase Compound ID a3osCBS9jE
InChI InChI=1S/C18H26S/c1-14(2)17-10-11-18(3,4)12-15(17)13-19-16-8-6-5-7-9-16/h5-9,15,17H,1,10-13H2,2-4H3/t15-,17-/m1/s1
InChIKey FOKAHBKBTAFZHA-NVXWUHKLSA-N
Mol Weight 274.47 g/mol
Molecular Formula C18H26S
Exact Mass 274.175522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hA8t7As5HH
Name trans-1,1-Dimethyl-3-((phenylthio)methyl)-4-(2-propenyl)cyclohexane
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Formula C18H26S
InChI InChI=1S/C18H26S/c1-14(2)17-10-11-18(3,4)12-15(17)13-19-16-8-6-5-7-9-16/h5-9,15,17H,1,10-13H2,2-4H3/t15-,17-/m1/s1
InChIKey FOKAHBKBTAFZHA-NVXWUHKLSA-N
Molecular Weight 274.466 g/mol
SMILES [C@@]1([C@](CC(CC1)(C)C)(CSc1ccccc1)[H])(C(=C)C)[H]
SPLASH splash10-0q2a-9810000000-3dc3b0af25a0dbe99222
Source of Spectrum J-61-501-7
Synonyms ({[(1S,2R)-2-allyl-5,5-dimethylcyclohexyl]methyl}sulfanyl)benzene trans-1,1-Dimethyl-3-((phenylthio)methyl)-4-(2-propen-2-yl)cyclohexane [(1S,2R)-2-allyl-5,5-dimethylcyclohexyl]methyl phenyl sulfide [[(1S,2S)-5,5-dimethyl-2-(1-methylethenyl)cyclohexyl]methylthio]benzene [(1S,2S)-5,5-dimethyl-2-prop-1-en-2-ylcyclohexyl]methylsulfanylbenzene [(1S,2S)-2-isopropenyl-5,5-dimethyl-cyclohexyl]methylsulfanylbenzene [(1S,2S)-5,5-dimethyl-2-prop-1-en-2-yl-cyclohexyl]methylsulfanylbenzene
Wiley ID 1278556