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(3S,4S)-4-(1-Benzothiophen-2-yl)-3,4-dihydroxybutan-2-one
SpectraBase Compound ID AofeaqQ3SsL
InChI InChI=1S/C12H12O3S/c1-7(13)11(14)12(15)10-6-8-4-2-3-5-9(8)16-10/h2-6,11-12,14-15H,1H3/t11-,12-/m1/s1
InChIKey HLAGOKUCIJRRJF-VXGBXAGGSA-N
Mol Weight 236.28 g/mol
Molecular Formula C12H12O3S
Exact Mass 236.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BUOn2oqrZSA
Name (3S,4S)-4-(1-Benzothiophen-2-yl)-3,4-dihydroxybutan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O3S
InChI InChI=1S/C12H12O3S/c1-7(13)11(14)12(15)10-6-8-4-2-3-5-9(8)16-10/h2-6,11-12,14-15H,1H3/t11-,12-/m1/s1
InChIKey HLAGOKUCIJRRJF-VXGBXAGGSA-N
Molecular Weight 236.285 g/mol
SMILES O[C@@]([C@@](c1sc2ccccc2c1)(O)[H])(C(=O)C)[H]
SPLASH splash10-01p7-7900000000-06d1596283af9f525da2
Source of Spectrum F-68-4779-4a
Wiley ID 1708999