| SpectraBase Spectrum ID |
EHdQvneBRir |
| Name |
1,3(2H,4H)-Isoquinolinedione, 4-[2-(3,4-dimethoxyphenyl)ethyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.131408092 u |
| Formula |
C19H19NO4 |
| InChI |
InChI=1S/C19H19NO4/c1-23-16-10-8-12(11-17(16)24-2)7-9-15-13-5-3-4-6-14(13)18(21)20-19(15)22/h3-6,8,10-11,15H,7,9H2,1-2H3,(H,20,21,22) |
| InChIKey |
YBEYAKJNWPUBMC-UHFFFAOYSA-N |
| Molecular Weight |
325.364 g/mol |
| SMILES |
C12=C(C=CC=C2)C(C(NC1=O)=O)CCC1=CC=C(C(=C1)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928831 |
![1,3(2H,4H)-Isoquinolinedione, 4-[2-(3,4-dimethoxyphenyl)ethyl]-](/api/spectrum/EHdQvneBRir/structure.png?h=300&w=458 "1,3(2H,4H)-Isoquinolinedione, 4-[2-(3,4-dimethoxyphenyl)ethyl]-")
