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(p-Hydroxyphenyl)acetonitrile, carbanilate (ester)

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 Raman

(p-Hydroxyphenyl)acetonitrile, carbanilate (ester)
SpectraBase Compound ID GrLiv3ROamf
InChI InChI=1S/C15H12N2O2/c16-11-10-12-6-8-14(9-7-12)19-15(18)17-13-4-2-1-3-5-13/h1-9H,10H2,(H,17,18)
InChIKey MIZOYFZCTNZOGR-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C15H12N2O2
Exact Mass 252.089878 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID CQOeCTHDdgv
Name (p-Hydroxyphenyl)acetonitrile, carbanilate (ester)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 252.089877632 u
Formula C15H12N2O2
InChI InChI=1S/C15H12N2O2/c16-11-10-12-6-8-14(9-7-12)19-15(18)17-13-4-2-1-3-5-13/h1-9H,10H2,(H,17,18)
InChIKey MIZOYFZCTNZOGR-UHFFFAOYSA-N
Molecular Weight 252.273 g/mol
SMILES N(C1=CC=CC=C1)C(OC=1C=CC(=CC1)CC#N)=O
Spectrum/Structure Validation Score (Raman) 0.922073