| SpectraBase Spectrum ID |
EbvxKEvVAur |
| Name |
3-(4-Isobutoxyphenyl)-3-methylpyrrolidine-2,5-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.136493473 u |
| Formula |
C15H19NO3 |
| InChI |
InChI=1S/C15H19NO3/c1-10(2)9-19-12-6-4-11(5-7-12)15(3)8-13(17)16-14(15)18/h4-7,10H,8-9H2,1-3H3,(H,16,17,18) |
| InChIKey |
UQHOLWAPQAEPNX-UHFFFAOYSA-N |
| Molecular Weight |
261.321 g/mol |
| SMILES |
C1(NC(=O)CC1(C1=CC=C(C=C1)OCC(C)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.81737 |