| SpectraBase Spectrum ID |
HOnWsPjYevd |
| Name |
4-(3,4-Dimethoxybenzoyl)-6,7-dimethoxy-2-methyl-isoquinolin-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
383.136887394 u |
| Formula |
C21H21NO6 |
| InChI |
InChI=1S/C21H21NO6/c1-22-11-15(20(23)12-6-7-16(25-2)17(8-12)26-3)13-9-18(27-4)19(28-5)10-14(13)21(22)24/h6-11H,1-5H3 |
| InChIKey |
VZMQORBQIZHKLA-UHFFFAOYSA-N |
| Molecular Weight |
383.400 g/mol |
| SMILES |
C=1(C2=C(C=C(C(=C2)OC)OC)C(N(C1)C)=O)C(C=1C=C(OC)C(=CC1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935251 |
