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2-Cyano-2-methyl-3-phenyl-propanoic acid

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2-Cyano-2-methyl-3-phenyl-propanoic acid
SpectraBase Compound ID 9NNHJ5uNvrn
InChI InChI=1S/C11H11NO2/c1-11(8-12,10(13)14)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,13,14)
InChIKey XOKVFRWKAZRXOS-UHFFFAOYSA-N
Mol Weight 189.21 g/mol
Molecular Formula C11H11NO2
Exact Mass 189.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FtwdWd3hH9Q
Name 2-cyano-2-methyl-3-phenyl-propanoic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO2
InChI InChI=1S/C11H11NO2/c1-11(8-12,10(13)14)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,13,14)
InChIKey XOKVFRWKAZRXOS-UHFFFAOYSA-N
Molecular Weight 189.214 g/mol
SMILES OC(C(C#N)(Cc1ccccc1)C)=O
SPLASH splash10-0006-9000000000-f81d3e805f2532237db5
Source of Spectrum KD-14-2138-3
Synonyms 2-cyano-2-methyl-3-phenyl-propionic acid
Wiley ID 1636153