| SpectraBase Spectrum ID |
1nbdKjTFVlJ |
| Name |
Benzamide, 2,5-difluoro-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 |
339.237370947 u |
| Formula |
C20H31F2NO |
| InChI |
InChI=1S/C20H31F2NO/c1-5-8-10-16(7-3)14-23(15(4)9-6-2)20(24)18-13-17(21)11-12-19(18)22/h11-13,15-16H,5-10,14H2,1-4H3 |
| InChIKey |
PSOFKVYAUJGMEV-UHFFFAOYSA-N |
| Molecular Weight |
339.471 g/mol |
| SMILES |
C(C1=C(C=CC(=C1)F)F)(N(CC(CCCC)CC)C(CCC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.816425 |
