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(E)-2-methyl-3-(phenylmethylthio)-2-propenoic acid methyl ester
SpectraBase Compound ID LADxNPaILVt
InChI InChI=1S/C12H14O2S/c1-10(12(13)14-2)8-15-9-11-6-4-3-5-7-11/h3-8H,9H2,1-2H3/b10-8+
InChIKey PBCIVFWXEVDEII-CSKARUKUSA-N
Mol Weight 222.3 g/mol
Molecular Formula C12H14O2S
Exact Mass 222.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9w9yRriRlLD
Name (E)-2-methyl-3-(phenylmethylthio)-2-propenoic acid methyl ester
Alternate Name(s) (E)-3-(benzylthio)-2-methyl-acrylic acid methyl ester Methyl (2E)-3-(benzylsulfanyl)-2-methyl-2-propenoate Methyl (E)-2-methyl-3-(phenylmethylsulfanyl)prop-2-enoate Methyl (E)-3-benzylsulfanyl-2-methyl-prop-2-enoate
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Formula C12H14O2S
InChI InChI=1S/C12H14O2S/c1-10(12(13)14-2)8-15-9-11-6-4-3-5-7-11/h3-8H,9H2,1-2H3/b10-8+
InChIKey PBCIVFWXEVDEII-CSKARUKUSA-N
Molecular Weight 222.302 g/mol
SMILES C(\C(=C\SCc1ccccc1)C)(=O)OC
SPLASH splash10-0006-9100000000-5d89628c29f4633f33bc
Source of Spectrum F-51-3623-8
Wiley ID 791456