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(2-cyanophenyl)acetic acid
SpectraBase Compound ID 3y2TV8fkiO5
InChI InChI=1S/C9H7NO2/c10-6-8-4-2-1-3-7(8)5-9(11)12/h1-4H,5H2,(H,11,12)
InChIKey QLHZKPQKYARBGT-UHFFFAOYSA-N
Mol Weight 161.16 g/mol
Molecular Formula C9H7NO2
Exact Mass 161.047678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4jnQFFNsffK
Name (2-cyanophenyl)acetic acid
Alternate Name(s) 2-(2-cyanophenyl)acetic acid 2-(2-cyanophenyl)ethanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7NO2
InChI InChI=1S/C9H7NO2/c10-6-8-4-2-1-3-7(8)5-9(11)12/h1-4H,5H2,(H,11,12)
InChIKey QLHZKPQKYARBGT-UHFFFAOYSA-N
Molecular Weight 161.160 g/mol
SMILES OC(Cc1c(C#N)cccc1)=O
SPLASH splash10-014i-6900000000-95d814b97bdc645d623e
Source of Spectrum D8-325-309-10
Wiley ID 1514408