trans-1,1-Dimethyl-3-[((2,4,6-triisopropylphenyl)thio)methyl]-4-(2-propenyl)cyclohexane

SpectraBase Compound ID	2EAyOY5t7sx
InChI	InChI=1S/C27H44S/c1-17(2)21-13-24(19(5)6)26(25(14-21)20(7)8)28-16-22-15-27(9,10)12-11-23(22)18(3)4/h13-14,17,19-20,22-23H,3,11-12,15-16H2,1-2,4-10H3/t22-,23-/m1/s1
InChIKey	ZMPUGZBQOJVXON-DHIUTWEWSA-N Google Search
Mol Weight	400.7 g/mol
Molecular Formula	C27H44S
Exact Mass	400.316373 g/mol

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SpectraBase Spectrum ID	KHUenisdDoU
Name	trans-1,1-Dimethyl-3-[((2,4,6-triisopropylphenyl)thio)methyl]-4-(2-propenyl)cyclohexane
Alternate Name(s)	2-({[(1S,2R)-2-allyl-5,5-dimethylcyclohexyl]methyl}sulfanyl)-1,3,5-triisopropylbenzene trans-1,1-Dimethyl-3-[((2,4,6-triisopropylphenyl)thio)methyl]-4-(2-isopropenyl)cyclohexane [(1S,2R)-2-allyl-5,5-dimethylcyclohexyl]methyl 2,4,6-triisopropylphenyl sulfide 2-[[(1S,2S)-5,5-dimethyl-2-(1-methylethenyl)cyclohexyl]methylthio]-1,3,5-tri(propan-2-yl)benzene 2-[[(1S,2S)-5,5-dimethyl-2-prop-1-en-2-ylcyclohexyl]methylsulfanyl]-1,3,5-tri(propan-2-yl)benzene 2-[[(1S,2S)-2-isopropenyl-5,5-dimethyl-cyclohexyl]methylsulfanyl]-1,3,5-triisopropyl-benzene 2-[[(1S,2S)-5,5-dimethyl-2-prop-1-en-2-yl-cyclohexyl]methylsulfanyl]-1,3,5-tri(propan-2-yl)benzene
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Formula	C27H44S
InChI	InChI=1S/C27H44S/c1-17(2)21-13-24(19(5)6)26(25(14-21)20(7)8)28-16-22-15-27(9,10)12-11-23(22)18(3)4/h13-14,17,19-20,22-23H,3,11-12,15-16H2,1-2,4-10H3/t22-,23-/m1/s1
InChIKey	ZMPUGZBQOJVXON-DHIUTWEWSA-N
Molecular Weight	400.709 g/mol
SMILES	c1(c(cc(cc1C(C)C)C(C)C)C(C)C)SC[C@@]1([C@@](C(=C)C)(CCC(C1)(C)C)[H])[H]
SPLASH	splash10-0k9j-2980000000-51a994e7d2b5ac86264f
Source of Spectrum	J-61-501-7
Wiley ID	1369755