| SpectraBase Spectrum ID |
INofTwPvXAD |
| Name |
Isopropyl 4,6-dioxo-3,5-diphenyl-perhydropyrrolo[3,4-C]pyrrole-1-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.157957192 u |
| Formula |
C22H22N2O4 |
| InChI |
InChI=1S/C22H22N2O4/c1-13(2)28-22(27)19-17-16(18(23-19)14-9-5-3-6-10-14)20(25)24(21(17)26)15-11-7-4-8-12-15/h3-13,16-19,23H,1-2H3 |
| InChIKey |
GKHODGIXBMDKHF-UHFFFAOYSA-N |
| Molecular Weight |
378.428 g/mol |
| SMILES |
C12C(C(=O)N(C2=O)C=2C=CC=CC2)C(C2=CC=CC=C2)NC1C(OC(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949834 |
![Isopropyl 4,6-dioxo-3,5-diphenyl-perhydropyrrolo[3,4-c]pyrrole-1-carboxylate](/api/spectrum/INofTwPvXAD/structure.png?h=300&w=458 "Isopropyl 4,6-dioxo-3,5-diphenyl-perhydropyrrolo[3,4-c]pyrrole-1-carboxylate")
