| SpectraBase Spectrum ID |
Kafx3WJ1lfT |
| Name |
1-Methyl-5-(3-oxo-2,3-diphenylpropyl)pyrrolidin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
307.157228918 u |
| Formula |
C20H21NO2 |
| InChI |
InChI=1S/C20H21NO2/c1-21-17(12-13-19(21)22)14-18(15-8-4-2-5-9-15)20(23)16-10-6-3-7-11-16/h2-11,17-18H,12-14H2,1H3 |
| InChIKey |
DFAWHFCXXLSSGC-UHFFFAOYSA-N |
| Molecular Weight |
307.393 g/mol |
| SMILES |
C=1C=C(C(C(C2=CC=CC=C2)CC2CCC(N2C)=O)=O)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828141 |