| SpectraBase Spectrum ID |
293qhzAFwjm |
| Name |
1(2H)-Isoquinolinone, 8-(3,4-dimethoxyphenyl)-3,4-dihydro-6,7-dimethoxy-2-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
357.157622840 u |
| Formula |
C20H23NO5 |
| InChI |
InChI=1S/C20H23NO5/c1-21-9-8-13-11-16(25-4)19(26-5)17(18(13)20(21)22)12-6-7-14(23-2)15(10-12)24-3/h6-7,10-11H,8-9H2,1-5H3 |
| InChIKey |
BNQILHGCWOUKLZ-UHFFFAOYSA-N |
| Molecular Weight |
357.406 g/mol |
| SMILES |
C=12C(C=3C=C(OC)C(=CC3)OC)=C(OC)C(=CC1CCN(C2=O)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817371 |
