| SpectraBase Spectrum ID |
HSK3F4QZhTR |
| Name |
Benzamide, 3-trifluoromethyl-2-fluoro-N-(3-trifluoromethyl-2-fluorobenzoyl)-N-pentyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
467.113154093 u |
| Formula |
C21H17F8NO2 |
| InChI |
InChI=1S/C21H17F8NO2/c1-2-3-4-11-30(18(31)12-7-5-9-14(16(12)22)20(24,25)26)19(32)13-8-6-10-15(17(13)23)21(27,28)29/h5-10H,2-4,11H2,1H3 |
| InChIKey |
ZNNXVRPDATVDRD-UHFFFAOYSA-N |
| Molecular Weight |
467.359 g/mol |
| SMILES |
C(N(CCCCC)C(C1=C(C(C(F)(F)F)=CC=C1)F)=O)(=O)C=1C=CC=C(C(F)(F)F)C1F |
