| SpectraBase Spectrum ID |
3eFX0MgKxMo |
| Name |
Benzamide, 3-chloro-2-fluoro-N-(2-pentyl)-N-(2-ethylhexyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
355.207820484 u |
| Formula |
C20H31ClFNO |
| InChI |
InChI=1S/C20H31ClFNO/c1-5-8-11-16(7-3)14-23(15(4)10-6-2)20(24)17-12-9-13-18(21)19(17)22/h9,12-13,15-16H,5-8,10-11,14H2,1-4H3 |
| InChIKey |
KVYNFXGDRJZUSI-UHFFFAOYSA-N |
| Molecular Weight |
355.925 g/mol |
| SMILES |
C(C1=C(C(=CC=C1)Cl)F)(N(CC(CCCC)CC)C(CCC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.888173 |
