| SpectraBase Spectrum ID |
2V8SM0CRX1Z |
| Name |
2,3-Dimethoxy-5,12B-dihydroisoindolo[1,2-A]isoquinolin-8(6H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
295.120843408 u |
| Formula |
C18H17NO3 |
| InChI |
InChI=1S/C18H17NO3/c1-21-15-9-11-7-8-19-17(14(11)10-16(15)22-2)12-5-3-4-6-13(12)18(19)20/h3-6,9-10,17H,7-8H2,1-2H3 |
| InChIKey |
MMHYYMDNTIDRIJ-UHFFFAOYSA-N |
| SMILES |
C12N(CCC=3C=C(C(=CC23)OC)OC)C(C=2C=CC=CC12)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942708 |
![2,3-Dimethoxy-5,12b-dihydroisoindolo[1,2-a]isoquinolin-8(6H)-one](/api/spectrum/2V8SM0CRX1Z/structure.png?h=300&w=458 "2,3-Dimethoxy-5,12b-dihydroisoindolo[1,2-a]isoquinolin-8(6H)-one")
