| SpectraBase Spectrum ID |
6MfNDogEsPC |
| Name |
1,5,6,10B-Tetrahydro-8,9-dimethoxy-10B-[(3,4-dimethoxyphenyl)methyl]pyrrolo[2,1-A]isoquinolin-3(2H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.188922968 u |
| Formula |
C23H27NO5 |
| InChI |
InChI=1S/C23H27NO5/c1-26-18-6-5-15(11-19(18)27-2)14-23-9-7-22(25)24(23)10-8-16-12-20(28-3)21(29-4)13-17(16)23/h5-6,11-13H,7-10,14H2,1-4H3 |
| InChIKey |
XSTAFWKSAJIBOU-UHFFFAOYSA-N |
| Molecular Weight |
397.471 g/mol |
| SMILES |
C12(N(C(=O)CC2)CCC2=C1C=C(C(OC)=C2)OC)CC=1C=C(OC)C(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.838101 |
![1,5,6,10b-tetrahydro-8,9-dimethoxy-10b-[(3,4-dimethoxyphenyl)methyl]pyrrolo[2,1-a]isoquinolin-3(2H)-one](/api/spectrum/6MfNDogEsPC/structure.png?h=300&w=458 "1,5,6,10b-tetrahydro-8,9-dimethoxy-10b-[(3,4-dimethoxyphenyl)methyl]pyrrolo[2,1-a]isoquinolin-3(2H)-one")
