| SpectraBase Spectrum ID |
Jd91v1rUZ2g |
| Name |
N-[2,5-Diethoxy-4-[(2,3,3,3-tetrafluoro-2-methoxy-1-oxopropyl)amino]phenyl]benzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
458.146484463 u |
| Formula |
C21H22F4N2O5 |
| InChI |
InChI=1S/C21H22F4N2O5/c1-4-31-16-12-15(27-19(29)20(22,30-3)21(23,24)25)17(32-5-2)11-14(16)26-18(28)13-9-7-6-8-10-13/h6-12H,4-5H2,1-3H3,(H,26,28)(H,27,29) |
| InChIKey |
QUECLPVNWFWNKC-UHFFFAOYSA-N |
| Molecular Weight |
458.410 g/mol |
| SMILES |
C(C(NC1=CC(OCC)=C(C=C1OCC)NC(=O)C=1C=CC=CC1)=O)(C(F)(F)F)(F)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921548 |
![N-[2,5-diethoxy-4-[(2,3,3,3-tetrafluoro-2-methoxy-1-oxopropyl)amino]phenyl]benzamide](/api/spectrum/Jd91v1rUZ2g/structure.png?h=300&w=458 "N-[2,5-diethoxy-4-[(2,3,3,3-tetrafluoro-2-methoxy-1-oxopropyl)amino]phenyl]benzamide")
