| SpectraBase Spectrum ID |
3NPlYmD6ZIY |
| Name |
rac-2,2'-Ethano-6,6',7,7'-tetramethoxy-1,1',2,2',3,3',4,4'-octahydro-1,1'-biisoquinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
410.220557450 u |
| Formula |
C24H30N2O4 |
| InChI |
InChI=1S/C24H30N2O4/c1-27-19-11-15-5-7-25-9-10-26-8-6-16-12-20(28-2)22(30-4)14-18(16)24(26)23(25)17(15)13-21(19)29-3/h11-14,23-24H,5-10H2,1-4H3/t23-,24-/m0/s1 |
| InChIKey |
PDNRCRRGKFUNIR-ZEQRLZLVSA-N |
| Molecular Weight |
410.514 g/mol |
| SMILES |
C1CC2=CC(=C(C=C2[C@]2([C@@]3(C4=C(C=C(C(=C4)OC)OC)CCN3CCN12)[H])[H])OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930957 |
