| SpectraBase Spectrum ID |
5ARSxnsd09O |
| Name |
5,6,10,11,15B,15C-Hexahydro-8-(3,4-dimethoxyphenyl)-2,3,13,14-tetramethoxy-8H-imidazo[5,1-A:4,3-A']diisoquinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
532.257336881 u |
| Formula |
C31H36N2O6 |
| InChI |
InChI=1S/C31H36N2O6/c1-34-23-8-7-20(15-24(23)35-2)31-32-11-9-18-13-25(36-3)27(38-5)16-21(18)29(32)30-22-17-28(39-6)26(37-4)14-19(22)10-12-33(30)31/h7-8,13-17,29-31H,9-12H2,1-6H3 |
| InChIKey |
XEQFNSMVPUPDCB-UHFFFAOYSA-N |
| Molecular Weight |
532.637 g/mol |
| SMILES |
C1(N2C(C3C4=C(CCN13)C=C(C(=C4)OC)OC)C=1C=C(OC)C(=CC1CC2)OC)C=1C=C(OC)C(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957046 |