| SpectraBase Spectrum ID |
4ixdBtVJ0kt |
| Name |
Benzamide, 3-chloro-2-fluoro-N-butyl-N-decyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.223470549 u |
| Formula |
C21H33ClFNO |
| InChI |
InChI=1S/C21H33ClFNO/c1-3-5-7-8-9-10-11-12-17-24(16-6-4-2)21(25)18-14-13-15-19(22)20(18)23/h13-15H,3-12,16-17H2,1-2H3 |
| InChIKey |
HKWIVQIBJHLWIL-UHFFFAOYSA-N |
| Molecular Weight |
369.952 g/mol |
| SMILES |
C1=CC=C(C(=C1Cl)F)C(N(CCCC)CCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923957 |
