| SpectraBase Spectrum ID |
9KXzy8IrBNa |
| Name |
3-(2'-Methoxybenzylidene)-1,3-dihydro-5-(p-methylphenyl)-2H-pyrrol-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
291.125928789 u |
| Formula |
C19H17NO2 |
| InChI |
InChI=1S/C19H17NO2/c1-13-7-9-14(10-8-13)17-12-16(19(21)20-17)11-15-5-3-4-6-18(15)22-2/h3-12H,1-2H3,(H,20,21)/b16-11- |
| InChIKey |
HGKJJUPPQMIRAA-WJDWOHSUSA-N |
| Molecular Weight |
291.350 g/mol |
| SMILES |
C1(\C(C=C(N1)C1=CC=C(C=C1)C)=C/C=1C(OC)=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.952367 |
