| SpectraBase Spectrum ID |
LZjPKuzuZAz |
| Name |
Benzamide, 2,4,5-trifluoro-3-methoxy-N-butyl-N-heptyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
359.207213633 u |
| Formula |
C19H28F3NO2 |
| InChI |
InChI=1S/C19H28F3NO2/c1-4-6-8-9-10-12-23(11-7-5-2)19(24)14-13-15(20)17(22)18(25-3)16(14)21/h13H,4-12H2,1-3H3 |
| InChIKey |
DXKPRSDDJIIJLQ-UHFFFAOYSA-N |
| Molecular Weight |
359.433 g/mol |
| SMILES |
C1(=C(C=C(C(=C1OC)F)C(N(CCCCCCC)CCCC)=O)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929101 |
