| SpectraBase Spectrum ID |
ApkCkmn9JzB |
| Name |
5,6,10,11,15B,15C-Hexahydro-8-(2-chlorophenyl)-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 |
506.197235182 u |
| Formula |
C29H31ClN2O4 |
| InChI |
InChI=1S/C29H31ClN2O4/c1-33-23-13-17-9-11-31-27(20(17)15-25(23)35-3)28-21-16-26(36-4)24(34-2)14-18(21)10-12-32(28)29(31)19-7-5-6-8-22(19)30/h5-8,13-16,27-29H,9-12H2,1-4H3 |
| InChIKey |
OOPVJEKCGVMGKC-UHFFFAOYSA-N |
| Molecular Weight |
507.030 g/mol |
| SMILES |
C1(N2C(C3C4=C(CCN13)C=C(C(=C4)OC)OC)C=1C=C(OC)C(=CC1CC2)OC)C=1C(Cl)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.803802 |
![5,6,10,11,15b,15c-Hexahydro-8-(2-chlorophenyl)-2,3,13,14-tetramethoxy-8H-imidazo[5,1-a:4,3-a']diisoquinoline](/api/spectrum/ApkCkmn9JzB/structure.png?h=300&w=458 "5,6,10,11,15b,15c-Hexahydro-8-(2-chlorophenyl)-2,3,13,14-tetramethoxy-8H-imidazo[5,1-a:4,3-a']diisoquinoline")
