SpectraBase Spectrum ID |
EkwZHW3BOjO |
Name |
Benzamide, pentafluoro-N-(2-phenylethyl)-N-hexyl- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
399.162155146 u |
Formula |
C21H22F5NO |
InChI |
InChI=1S/C21H22F5NO/c1-2-3-4-8-12-27(13-11-14-9-6-5-7-10-14)21(28)15-16(22)18(24)20(26)19(25)17(15)23/h5-7,9-10H,2-4,8,11-13H2,1H3 |
InChIKey |
IBSNHEZOSHHMKF-UHFFFAOYSA-N |
Molecular Weight |
399.405 g/mol |
SMILES |
C1=CC=CC(=C1)CCN(C(=O)C=1C(=C(C(F)=C(C1F)F)F)F)CCCCCC |