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5-(2-Aminophenylthio)penten-3,4-diol
SpectraBase Compound ID 8kKbE8nAPtp
InChI InChI=1S/C11H15NO2S/c1-2-9(13)10(14)7-15-11-6-4-3-5-8(11)12/h2-6,9-10,13-14H,1,7,12H2/t9-,10+/m0/s1
InChIKey BCAVYDJACCUOHC-VHSXEESVSA-N
Mol Weight 225.31 g/mol
Molecular Formula C11H15NO2S
Exact Mass 225.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5qHHTYDTzI
Name 5-(2-Aminophenylthio)penten-3,4-diol
Alternate Name(s) (2S,3S)-1-(2-Amino-phenylsulfanyl)-pent-4-ene-2,3-diol 5-S-(2-aminophenyl)-1,2-dideoxy-5-thiopent-1-enitol (2S,3S)-1-[(2-aminophenyl)thio]-4-pentene-2,3-diol (2S,3S)-1-(2-aminophenyl)sulfanylpent-4-ene-2,3-diol
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Formula C11H15NO2S
InChI InChI=1S/C11H15NO2S/c1-2-9(13)10(14)7-15-11-6-4-3-5-8(11)12/h2-6,9-10,13-14H,1,7,12H2/t9-,10+/m0/s1
InChIKey BCAVYDJACCUOHC-VHSXEESVSA-N
Molecular Weight 225.306 g/mol
SMILES Nc1c(SC[C@]([C@](C=C)(O)[H])(O)[H])cccc1
SPLASH splash10-00b9-0790000000-fa47e89cf3eccacf3dbb
Source of Spectrum QC-4-1535-3
Wiley ID 883398