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(SS,2S,3S)-2-Cyclohexylsulfinyl-N,N-dimethyl-3-phenylpent-4-enethioamide
SpectraBase Compound ID 3IhZLTo6h1n
InChI InChI=1S/C19H27NO2S/c1-4-17(15-11-7-5-8-12-15)18(19(21)20(2)3)23(22)16-13-9-6-10-14-16/h4-5,7-8,11-12,16-18H,1,6,9-10,13-14H2,2-3H3/t17-,18-,23?/m0/s1
InChIKey QGNWOGGXULMWRE-JOHXPNBHSA-N
Mol Weight 333.49 g/mol
Molecular Formula C19H27NO2S
Exact Mass 333.17625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWKC6nrCjVZ
Name (SS,2S,3S)-2-Cyclohexylsulfinyl-N,N-dimethyl-3-phenylpent-4-enethioamide
Alternate Name(s) (2S,3S)-2-[(S)-cyclohexylsulfinyl]-N,N-dimethyl-3-phenyl-4-pentenamide (2S,3S)-2-[(S)-cyclohexylsulfinyl]-N,N-dimethyl-3-phenylpent-4-enamide
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Formula C19H27NO2S
InChI InChI=1S/C19H27NO2S/c1-4-17(15-11-7-5-8-12-15)18(19(21)20(2)3)23(22)16-13-9-6-10-14-16/h4-5,7-8,11-12,16-18H,1,6,9-10,13-14H2,2-3H3/t17-,18-,23?/m0/s1
InChIKey QGNWOGGXULMWRE-JOHXPNBHSA-N
Molecular Weight 333.490 g/mol
SMILES [C@]([S@@](=O)C1CCCCC1)(C(N(C)C)=O)([C@@](C=C)(c1ccccc1)[H])[H]
SPLASH splash10-001i-3910000000-23b9bfee45368cd48d65
Source of Spectrum J-66-7847-7
Wiley ID 1568507