| SpectraBase Spectrum ID |
JnrAFpo5Lv5 |
| Name |
N-(2,5-Dioxo-1-phenyl-3-pyrrolidinyl)-2,2,3,3,4,4,4-heptafluoro-N-(2-phenylethyl)butanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
490.112739553 u |
| Formula |
C22H17F7N2O3 |
| InChI |
InChI=1S/C22H17F7N2O3/c23-20(24,21(25,26)22(27,28)29)19(34)30(12-11-14-7-3-1-4-8-14)16-13-17(32)31(18(16)33)15-9-5-2-6-10-15/h1-10,16H,11-13H2 |
| InChIKey |
PYYBHNGFBRGEAC-UHFFFAOYSA-N |
| Molecular Weight |
490.378 g/mol |
| SMILES |
C(C(C(F)(F)F)(F)F)(C(N(C1C(N(C=2C=CC=CC2)C(C1)=O)=O)CCC=1C=CC=CC1)=O)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.843932 |
