SpectraBase Spectrum ID |
BhkAWfS5ZSy |
Name |
3,4-Dihydroisoquinoline, 1-[1-phenethyl]-6,7-dimethoxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.157228918 u |
Formula |
C19H21NO2 |
InChI |
InChI=1S/C19H21NO2/c1-13(14-7-5-4-6-8-14)19-16-12-18(22-3)17(21-2)11-15(16)9-10-20-19/h4-8,11-13H,9-10H2,1-3H3 |
InChIKey |
AKTJHXSJSOWZSR-UHFFFAOYSA-N |
SMILES |
COC1=CC2=C(C(=NCC2)C(C2=CC=CC=C2)C)C=C1OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898679 |