| SpectraBase Spectrum ID |
9dmxK6WpDzi |
| Name |
Benzamide, 2,6-difluoro-3-methyl-N-(2-phenylethyl)-N-heptyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
373.221720883 u |
| Formula |
C23H29F2NO |
| InChI |
InChI=1S/C23H29F2NO/c1-3-4-5-6-10-16-26(17-15-19-11-8-7-9-12-19)23(27)21-20(24)14-13-18(2)22(21)25/h7-9,11-14H,3-6,10,15-17H2,1-2H3 |
| InChIKey |
MQQKQWZFYLBWCG-UHFFFAOYSA-N |
| Molecular Weight |
373.488 g/mol |
| SMILES |
C1=CC=CC(=C1)CCN(C(=O)C=1C(=CC=C(C1F)C)F)CCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879833 |
