SpectraBase Spectrum ID |
9LVTImGTA8c |
Name |
2-Chlorobenzamide, N-(2-phenylethyl)-N-(2-heptyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
357.185942225 u |
Formula |
C22H28ClNO |
InChI |
InChI=1S/C22H28ClNO/c1-3-4-6-11-18(2)24(17-16-19-12-7-5-8-13-19)22(25)20-14-9-10-15-21(20)23/h5,7-10,12-15,18H,3-4,6,11,16-17H2,1-2H3 |
InChIKey |
PKHMUCZDUAQARQ-UHFFFAOYSA-N |
Molecular Weight |
357.925 g/mol |
SMILES |
C1(=C(C=CC=C1)C(N(C(CCCCC)C)CCC1=CC=CC=C1)=O)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940441 |