| SpectraBase Spectrum ID |
9tiGOESUcns |
| Name |
6,7-Dimethoxy-1-(p-methoxyphenyl)-3,4-dihydroisoquinoline - N-oxide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
313.131408092 u |
| Formula |
C18H19NO4 |
| InChI |
InChI=1S/C18H19NO4/c1-21-14-6-4-12(5-7-14)18-15-11-17(23-3)16(22-2)10-13(15)8-9-19(18)20/h4-7,10-11H,8-9H2,1-3H3 |
| InChIKey |
FGFDPVNPHJPWML-UHFFFAOYSA-N |
| Molecular Weight |
313.353 g/mol |
| SMILES |
C1(=[N+](CCC=2C=C(C(=CC12)OC)OC)[O-])C=1C=CC(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918594 |
