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5-(Phenylthio)penten-3,4-diol
SpectraBase Compound ID C6VmU70TXWT
InChI InChI=1S/C11H14O2S/c1-2-10(12)11(13)8-14-9-6-4-3-5-7-9/h2-7,10-13H,1,8H2/t10-,11+/m0/s1
InChIKey KIJGUOQBZWAVAZ-WDEREUQCSA-N
Mol Weight 210.29 g/mol
Molecular Formula C11H14O2S
Exact Mass 210.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GfCtdXYBar
Name 5-(Phenylthio)penten-3,4-diol
Alternate Name(s) (2S,3S)-1-Phenylsulfanyl-pent-4-ene-2,3-diol 1,2-Dideoxy-5-S-phenyl-5-thiopent-1-enitol
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Formula C11H14O2S
InChI InChI=1S/C11H14O2S/c1-2-10(12)11(13)8-14-9-6-4-3-5-7-9/h2-7,10-13H,1,8H2/t10-,11+/m0/s1
InChIKey KIJGUOQBZWAVAZ-WDEREUQCSA-N
Molecular Weight 210.291 g/mol
SMILES O[C@]([C@@](CSc1ccccc1)(O)[H])(C=C)[H]
SPLASH splash10-052r-0900000000-e3feefca0a4c5b8abd96
Source of Spectrum QC-4-1535-3
Wiley ID 883399