SpectraBase Spectrum ID |
HJrLGNf8EWG |
Name |
Benzamide, 4-chloro-N-(2-ethylphenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
259.076391774 u |
Formula |
C15H14ClNO |
InChI |
InChI=1S/C15H14ClNO/c1-2-11-5-3-4-6-14(11)17-15(18)12-7-9-13(16)10-8-12/h3-10H,2H2,1H3,(H,17,18) |
InChIKey |
MJZLBXZPYDGCTQ-UHFFFAOYSA-N |
Molecular Weight |
259.736 g/mol |
SMILES |
C1=C(C=CC(=C1)Cl)C(=O)NC1=CC=CC=C1CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.93765 |