| SpectraBase Spectrum ID |
3eKublGIygM |
| Name |
Benzamide, 3-chloro-2-fluoro-N-methyl-N-hexyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
271.113920098 u |
| Formula |
C14H19ClFNO |
| InChI |
InChI=1S/C14H19ClFNO/c1-3-4-5-6-10-17(2)14(18)11-8-7-9-12(15)13(11)16/h7-9H,3-6,10H2,1-2H3 |
| InChIKey |
BAFDIHFELHTWPE-UHFFFAOYSA-N |
| Molecular Weight |
271.763 g/mol |
| SMILES |
C1=CC=C(C(=C1Cl)F)C(N(C)CCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.806577 |
