| SpectraBase Spectrum ID |
4WDlh8RAvxz |
| Name |
1,4-Dibenzyl-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydro-isoquinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
387.219829176 u |
| Formula |
C26H29NO2 |
| InChI |
InChI=1S/C26H29NO2/c1-27-18-21(14-19-10-6-4-7-11-19)22-16-25(28-2)26(29-3)17-23(22)24(27)15-20-12-8-5-9-13-20/h4-13,16-17,21,24H,14-15,18H2,1-3H3 |
| InChIKey |
RMWVEMOAIJSAFD-UHFFFAOYSA-N |
| Molecular Weight |
387.523 g/mol |
| SMILES |
C1=CC=CC(=C1)CC1N(C)CC(C2=C1C=C(OC)C(=C2)OC)CC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939262 |
