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3-Hydroxy-4-(phenylthio)butanoic acid methyl ester
SpectraBase Compound ID 3SZaDWP5IM8
InChI InChI=1S/C11H14O3S/c1-14-11(13)7-9(12)8-15-10-5-3-2-4-6-10/h2-6,9,12H,7-8H2,1H3
InChIKey YDLBMPUGGXCLRU-UHFFFAOYSA-N
Mol Weight 226.29 g/mol
Molecular Formula C11H14O3S
Exact Mass 226.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Btipenr04cW
Name 3-HYDROXY-4-PHENYLSULFANYLBUTYRIC ACID, METHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H14O3S
InChI InChI=1S/C11H14O3S/c1-14-11(13)7-9(12)8-15-10-5-3-2-4-6-10/h2-6,9,12H,7-8H2,1H3
InChIKey YDLBMPUGGXCLRU-UHFFFAOYSA-N
Molecular Weight 226.0660
SMILES OC(CC(OC)=O)CSc1ccccc1
SPLASH splash10-00di-9610000000-bd7e4fe2e6548698c685
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany