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5-(Benzylthio)penten-3,4-diol
SpectraBase Compound ID D2eSMi9hyKI
InChI InChI=1S/C12H16O2S/c1-2-11(13)12(14)9-15-8-10-6-4-3-5-7-10/h2-7,11-14H,1,8-9H2/t11-,12+/m0/s1
InChIKey CBJVGNLPFQKHBU-NWDGAFQWSA-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 LjdwKyK3aO8
Name 5-(Benzylthio)penten-3,4-diol
Alternate Name(s) (2S,3S)-1-Benzylsulfanyl-pent-4-ene-2,3-diol 5-S-benzyl-1,2-dideoxy-5-thiopent-1-enitol
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Formula C12H16O2S
InChI InChI=1S/C12H16O2S/c1-2-11(13)12(14)9-15-8-10-6-4-3-5-7-10/h2-7,11-14H,1,8-9H2/t11-,12+/m0/s1
InChIKey CBJVGNLPFQKHBU-NWDGAFQWSA-N
Molecular Weight 224.318 g/mol
SMILES O[C@]([C@](O)(CSCc1ccccc1)[H])(C=C)[H]
SPLASH splash10-0006-9410000000-c959037b263481632d6a
Source of Spectrum QC-4-1535-3
Wiley ID 883400