SpectraBase Spectrum ID |
AhoNeSj9o9d |
Name |
Benzamide, 2-chloro-N-(2-butyl)-N-undecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
365.248542482 u |
Formula |
C22H36ClNO |
InChI |
InChI=1S/C22H36ClNO/c1-4-6-7-8-9-10-11-12-15-18-24(19(3)5-2)22(25)20-16-13-14-17-21(20)23/h13-14,16-17,19H,4-12,15,18H2,1-3H3 |
InChIKey |
RMZSUQFUWRQZTP-UHFFFAOYSA-N |
Molecular Weight |
365.989 g/mol |
SMILES |
C(N(CCCCCCCCCCC)C(CC)C)(=O)C=1C(Cl)=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.856479 |