| SpectraBase Spectrum ID |
2B7hjiINYhB |
| Name |
Benzamide, 3-methoxy-2,4,5-trifluoro-N-(2-pentyl)-N-dodecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
443.301114019 u |
| Formula |
C25H40F3NO2 |
| InChI |
InChI=1S/C25H40F3NO2/c1-5-7-8-9-10-11-12-13-14-15-17-29(19(3)16-6-2)25(30)20-18-21(26)23(28)24(31-4)22(20)27/h18-19H,5-17H2,1-4H3 |
| InChIKey |
YLFBNMMBIZBIIS-UHFFFAOYSA-N |
| Molecular Weight |
443.595 g/mol |
| SMILES |
C(C1=C(C(=C(C(=C1)F)F)OC)F)(N(CCCCCCCCCCCC)C(CCC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.860908 |
