| SpectraBase Spectrum ID |
5PEysSffXIa |
| Name |
Benzamide, 4-chloro-3-methyl-N-allyl-N-decyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.217242353 u |
| Formula |
C21H32ClNO |
| InChI |
InChI=1S/C21H32ClNO/c1-4-6-7-8-9-10-11-12-16-23(15-5-2)21(24)19-13-14-20(22)18(3)17-19/h5,13-14,17H,2,4,6-12,15-16H2,1,3H3 |
| InChIKey |
IIRKGQAMVJVSST-UHFFFAOYSA-N |
| Molecular Weight |
349.946 g/mol |
| SMILES |
C(N(CCCCCCCCCC)CC=C)(=O)C=1C=C(C(=CC1)Cl)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908115 |
