| SpectraBase Spectrum ID |
6aeIc1vCUgp |
| Name |
Benzamide, 4-chloro-N-(2-pentyl)-N-hexadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
449.342442869 u |
| Formula |
C28H48ClNO |
| InChI |
InChI=1S/C28H48ClNO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-24-30(25(3)19-5-2)28(31)26-20-22-27(29)23-21-26/h20-23,25H,4-19,24H2,1-3H3 |
| InChIKey |
ZVTAOJAYBJXLLP-UHFFFAOYSA-N |
| Molecular Weight |
450.151 g/mol |
| SMILES |
C(N(C(CCC)C)C(=O)C=1C=CC(=CC1)Cl)CCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.820307 |
