| SpectraBase Spectrum ID |
4ygoSHbxwqp |
| Name |
Benzamide, 4-trifluoromethyl-N-methyl-N-(hept-2-yl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
301.165348820 u |
| Formula |
C16H22F3NO |
| InChI |
InChI=1S/C16H22F3NO/c1-4-5-6-7-12(2)20(3)15(21)13-8-10-14(11-9-13)16(17,18)19/h8-12H,4-7H2,1-3H3 |
| InChIKey |
CKAHEQLCDYTBMR-UHFFFAOYSA-N |
| Molecular Weight |
301.353 g/mol |
| SMILES |
C(=O)(N(C(CCCCC)C)C)C=1C=CC(=CC1)C(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.877369 |
