SpectraBase Spectrum ID |
3TBMNgFTPSd |
Name |
4-Ethoxy-N-(2-methylphenyl)benzamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
255.125928789 u |
Formula |
C16H17NO2 |
InChI |
InChI=1S/C16H17NO2/c1-3-19-14-10-8-13(9-11-14)16(18)17-15-7-5-4-6-12(15)2/h4-11H,3H2,1-2H3,(H,17,18) |
InChIKey |
BNWPFZLDQOYQKW-UHFFFAOYSA-N |
Molecular Weight |
255.317 g/mol |
SMILES |
C1(NC(=O)C2=CC=C(C=C2)OCC)=C(C=CC=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914249 |