SpectraBase Spectrum ID |
ATgFiDrnbs |
Name |
(3R)-3-(3,4-Dimethoxyphenyl)-7,8-dimethoxy-1,2,3,4-tetrahydroisoquinoline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
329.162708221 u |
Formula |
C19H23NO4 |
InChI |
InChI=1S/C19H23NO4/c1-21-16-7-6-13(10-18(16)23-3)15-9-12-5-8-17(22-2)19(24-4)14(12)11-20-15/h5-8,10,15,20H,9,11H2,1-4H3/t15-/m1/s1 |
InChIKey |
GUVWTRINPPFWAS-OAHLLOKOSA-N |
Molecular Weight |
329.396 g/mol |
SMILES |
C1N[C@](CC=2C=CC(=C(C12)OC)OC)(C=1C=C(C(=CC1)OC)OC)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972237 |