| SpectraBase Spectrum ID |
9DgXwcwYftb |
| Name |
1H-Pyrrole-2,5-dione, 3-(1,3,3A,4,7,7A-hexahydro-2H-isoindol-2-yl)dihydro-1-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.136827826 u |
| Formula |
C13H18N2O2 |
| InChI |
InChI=1S/C13H18N2O2/c1-14-12(16)6-11(13(14)17)15-7-9-4-2-3-5-10(9)8-15/h2-3,9-11H,4-8H2,1H3 |
| InChIKey |
DNJPYCLPJLEWCE-UHFFFAOYSA-N |
| Molecular Weight |
234.299 g/mol |
| SMILES |
C1(N(C(=O)CC1N1CC2C(CC=CC2)C1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.982965 |
