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(3S,4R)-4-(3-Chloro-1-benzothiophen-2-yl)-3,4-dihydroxybutan-2-one
SpectraBase Compound ID gk6UhKU5IM
InChI InChI=1S/C12H11ClO3S/c1-6(14)10(15)11(16)12-9(13)7-4-2-3-5-8(7)17-12/h2-5,10-11,15-16H,1H3/t10-,11-/m1/s1
InChIKey HMCXPJHYVSAPJE-GHMZBOCLSA-N
Mol Weight 270.73 g/mol
Molecular Formula C12H11ClO3S
Exact Mass 270.011743 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ZjbqsObb7W
Name (3S,4R)-4-(3-Chloro-1-benzothiophen-2-yl)-3,4-dihydroxybutan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11ClO3S
InChI InChI=1S/C12H11ClO3S/c1-6(14)10(15)11(16)12-9(13)7-4-2-3-5-8(7)17-12/h2-5,10-11,15-16H,1H3/t10-,11-/m1/s1
InChIKey HMCXPJHYVSAPJE-GHMZBOCLSA-N
Molecular Weight 270.730 g/mol
SMILES O[C@@]([C@](c1sc2ccccc2c1Cl)(O)[H])(C(=O)C)[H]
SPLASH splash10-006t-4910000000-2eef171410a30289cff2
Source of Spectrum F-68-4779-4c
Wiley ID 1708996