For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-Cyano-benzoic acid
SpectraBase Compound ID FRr8scT0BVw
InChI InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)
InChIKey ADCUEPOHPCPMCE-UHFFFAOYSA-N
Mol Weight 147.13 g/mol
Molecular Formula C8H5NO2
Exact Mass 147.032028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6jPGX5IFKpt
Name Benzoic acid, 4-cyano-
CAS Registry Number 619-65-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5NO2
InChI InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)
InChIKey ADCUEPOHPCPMCE-UHFFFAOYSA-N
Molecular Weight 147.133 g/mol
SMILES OC(=O)c1ccc(C#N)cc1
SPLASH splash10-0f8a-4900000000-b969af300a2dc647a527
Source of Spectrum HE-1986-769-0
Synonyms 4-Carboxybenzonitrile 4-Cyanobenzoic acid Benzoic acid, p-cyano- p-Carboxybenzonitrile Terephthalic mononitrile EINECS 210-606-9 NSC 6306
Wiley ID 1144795