SpectraBase Spectrum ID |
J7UMYMJGTqM |
Name |
N-(2-Cyanophenyl)benzamide, N-acetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
264.089877632 u |
Formula |
C16H12N2O2 |
InChI |
InChI=1S/C16H12N2O2/c1-12(19)18(15-10-6-5-9-14(15)11-17)16(20)13-7-3-2-4-8-13/h2-10H,1H3 |
InChIKey |
HBOKQAFKVSQRHQ-UHFFFAOYSA-N |
Molecular Weight |
264.284 g/mol |
SMILES |
C1(N(C(=O)C2=CC=CC=C2)C(C)=O)=C(C=CC=C1)C#N |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960342 |