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(2S)-3-cyano-2-phenyl-propanoic acid
SpectraBase Compound ID DGPqvEuko5v
InChI InChI=1S/C10H9NO2/c11-7-6-9(10(12)13)8-4-2-1-3-5-8/h1-5,9H,6H2,(H,12,13)/t9-/m0/s1
InChIKey XBZQKMPPVQSLHI-VIFPVBQESA-N
Mol Weight 175.19 g/mol
Molecular Formula C10H9NO2
Exact Mass 175.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bnxb2o1G5B9
Name (2S)-3-cyano-2-phenyl-propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO2
InChI InChI=1S/C10H9NO2/c11-7-6-9(10(12)13)8-4-2-1-3-5-8/h1-5,9H,6H2,(H,12,13)/t9-/m0/s1
InChIKey XBZQKMPPVQSLHI-VIFPVBQESA-N
Molecular Weight 175.187 g/mol
SMILES OC([C@](c1ccccc1)(CC#N)[H])=O
SPLASH splash10-0fai-0900000000-adc61b1491b1dfa67e17
Source of Spectrum KC-0-625-8
Synonyms (2S)-3-cyano-2-phenyl-propionic acid
Wiley ID 785333