SpectraBase Spectrum ID |
96ff9kd3IXo |
Name |
Trans-cinnamamide, 3-trifluoromethyl-N-(hept-2-yl)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
313.165348820 u |
Formula |
C17H22F3NO |
InChI |
InChI=1S/C17H22F3NO/c1-3-4-5-7-13(2)21-16(22)11-10-14-8-6-9-15(12-14)17(18,19)20/h6,8-13H,3-5,7H2,1-2H3,(H,21,22)/b11-10+ |
InChIKey |
OIXZVPHWYSWXEY-ZHACJKMWSA-N |
Molecular Weight |
313.364 g/mol |
SMILES |
C1=C(C=C(C=C1)\C=C\C(NC(CCCCC)C)=O)C(F)(F)F |