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Methyl 2-[trans-2-(phenylsulfanyl)cyclohexyl]acrylate
SpectraBase Compound ID J3JBqdFd9WU
InChI InChI=1S/C16H20O2S/c1-12(16(17)18-2)14-10-6-7-11-15(14)19-13-8-4-3-5-9-13/h3-5,8-9,14-15H,1,6-7,10-11H2,2H3/t14-,15+/m1/s1
InChIKey GLGUKCWFUSMIFO-CABCVRRESA-N
Mol Weight 276.39 g/mol
Molecular Formula C16H20O2S
Exact Mass 276.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FjzzCBN9ZxE
Name Methyl 2-[trans-2-(phenylsulfanyl)cyclohexyl]acrylate
Alternate Name(s) Methyl 2-[(1R,2S)-2-(phenylsulfanyl)cyclohexyl]acrylate
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Formula C16H20O2S
InChI InChI=1S/C16H20O2S/c1-12(16(17)18-2)14-10-6-7-11-15(14)19-13-8-4-3-5-9-13/h3-5,8-9,14-15H,1,6-7,10-11H2,2H3/t14-,15+/m1/s1
InChIKey GLGUKCWFUSMIFO-CABCVRRESA-N
Molecular Weight 276.394 g/mol
SMILES C([C@@]1([C@@](Sc2ccccc2)(CCCC1)[H])[H])(C(=O)OC)=C
SPLASH splash10-0699-4910000000-e761c49cb7b0b41f9854
Source of Spectrum KC-61-4378-7
Wiley ID 1628951