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2-Benzyl-3-hydroxypropanoic acid

View entire compound with spectra: 2 MS (GC)

2-Benzyl-3-hydroxypropanoic acid
SpectraBase Compound ID 6RQaQShBxQ9
InChI InChI=1S/C10H12O3/c11-7-9(10(12)13)6-8-4-2-1-3-5-8/h1-5,9,11H,6-7H2,(H,12,13)
InChIKey RDUHFHDKXQBHMH-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FBOCWaXyjM
Name 2-Benzyl-3-hydroxypropanoic acid
Alternate Name(s) 2-(hydroxymethyl)-3-phenyl-propanoic acid 2-Benzyl-3-hydroxy-propionic acid Benzenepropanoic acid, .alpha.-(hydroxymethyl)- 2-(hydroxymethyl)-3-phenylpropanoic acid
CAS Registry Number 6811-98-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c11-7-9(10(12)13)6-8-4-2-1-3-5-8/h1-5,9,11H,6-7H2,(H,12,13)
InChIKey RDUHFHDKXQBHMH-UHFFFAOYSA-N
Molecular Weight 180.203 g/mol
SMILES OC(C(CO)Cc1ccccc1)=O
SPLASH splash10-00kf-8900000000-aaf2645a8fd3b366e48f
Wiley ID 1489276