| SpectraBase Spectrum ID |
4lVvD2Oa3E3 |
| Name |
Benzamide, 3-chloro-2-fluoro-N-butyl-N-nonyl- |
| 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/c1-3-5-7-8-9-10-11-16-23(15-6-4-2)20(24)17-13-12-14-18(21)19(17)22/h12-14H,3-11,15-16H2,1-2H3 |
| InChIKey |
YGNYEJNAZMFIJI-UHFFFAOYSA-N |
| Molecular Weight |
355.925 g/mol |
| SMILES |
C1=CC=C(C(=C1Cl)F)C(N(CCCC)CCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902824 |
