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(2S,3S)-S-ethyl 3-hydroxy-2-methyl-3-phenylpropanethioate
SpectraBase Compound ID 8UPYsKy2c36
InChI InChI=1S/C12H16O2S/c1-3-15-12(14)9(2)11(13)10-7-5-4-6-8-10/h4-9,11,13H,3H2,1-2H3/t9-,11-/m0/s1
InChIKey AGLPVZIZUJHJOQ-ONGXEEELSA-N
Mol Weight 224.32 g/mol
Molecular Formula C12H16O2S
Exact Mass 224.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6jfvLKSFo5g
Name (2S,3S)-S-ethyl 3-hydroxy-2-methyl-3-phenylpropanethioate
Alternate Name(s) (2S,3S)-3-hydroxy-2-methyl-3-phenylpropanethioic acid S-ethyl ester S-ethyl (2S,3S)-3-hydroxy-2-methyl-3-phenylpropanethioate S-ethyl (2S,3S)-3-hydroxy-2-methyl-3-phenyl-propanethioate S-ethyl (2S,3S)-2-methyl-3-oxidanyl-3-phenyl-propanethioate
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Formula C12H16O2S
InChI InChI=1S/C12H16O2S/c1-3-15-12(14)9(2)11(13)10-7-5-4-6-8-10/h4-9,11,13H,3H2,1-2H3/t9-,11-/m0/s1
InChIKey AGLPVZIZUJHJOQ-ONGXEEELSA-N
Literature Reference DOI 10.1002/cjoc.200591561
Molecular Weight 224.318 g/mol
SMILES O[C@@]([C@@](C(SCC)=O)(C)[H])(c1ccccc1)[H]
SPLASH splash10-0a4i-7900000000-5e4d44045089da644a54
Source of Spectrum CJC-23-1562-2a
Wiley ID 1774150