| SpectraBase Spectrum ID |
Bumg3fd2ery |
| Name |
Trans-cinnamamide, N-(3-methylphenyl)-3-trifluoromethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.102748563 u |
| Formula |
C17H14F3NO |
| InChI |
InChI=1S/C17H14F3NO/c1-12-4-2-7-15(10-12)21-16(22)9-8-13-5-3-6-14(11-13)17(18,19)20/h2-11H,1H3,(H,21,22)/b9-8+ |
| InChIKey |
XYPIIKLMVAJECA-CMDGGOBGSA-N |
| Molecular Weight |
305.300 g/mol |
| SMILES |
C1(=CC=CC(=C1)\C=C\C(NC1=CC(C)=CC=C1)=O)C(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.857943 |
