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rel(1S,2S)-1-Methyl-2(2-methylthio-phenyl)-1-phenylcyclopentane
SpectraBase Compound ID 56kSef6wlyw
InChI InChI=1S/C19H22S/c1-19(15-9-4-3-5-10-15)14-8-12-17(19)16-11-6-7-13-18(16)20-2/h3-7,9-11,13,17H,8,12,14H2,1-2H3/t17-,19-/m1/s1
InChIKey ISUIHLKIVQHEGQ-IEBWSBKVSA-N
Mol Weight 282.44 g/mol
Molecular Formula C19H22S
Exact Mass 282.144222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Wip1KUfKwG
Name rel(1S,2S)-1-Methyl-2(2-methylthio-phenyl)-1-phenylcyclopentane
Alternate Name(s) 1-[(1S,2S)-2-methyl-2-phenylcyclopentyl]-2-(methylsulfanyl)benzene Methyl 2-[(1S,2S)-2-methyl-2-phenylcyclopentyl]phenyl sulfide rel(1S,2S)-1-Methyl-2-methylthiophenyl-1-phenylcyclopentane
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Formula C19H22S
InChI InChI=1S/C19H22S/c1-19(15-9-4-3-5-10-15)14-8-12-17(19)16-11-6-7-13-18(16)20-2/h3-7,9-11,13,17H,8,12,14H2,1-2H3/t17-,19-/m1/s1
InChIKey ISUIHLKIVQHEGQ-IEBWSBKVSA-N
Molecular Weight 282.445 g/mol
SMILES [C@@]1([C@@](c2c(SC)cccc2)(CCC1)[H])(c1ccccc1)C
SPLASH splash10-0a4l-9700000000-e06d7632d167364a36f5
Source of Spectrum F-52-7452-4
Wiley ID 796832