SpectraBase Spectrum ID |
7OBpKeobyyW |
Name |
Benzamide, N-(2,5-dimethoxyphenyl)-4-chloro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
291.066221012 u |
Formula |
C15H14ClNO3 |
InChI |
InChI=1S/C15H14ClNO3/c1-19-12-7-8-14(20-2)13(9-12)17-15(18)10-3-5-11(16)6-4-10/h3-9H,1-2H3,(H,17,18) |
InChIKey |
HCVYUDNPZQUVRH-UHFFFAOYSA-N |
SMILES |
C1=C(C=CC(=C1)C(NC1=C(OC)C=CC(OC)=C1)=O)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.894593 |