SpectraBase Spectrum ID |
DBf4rOcMAyE |
Name |
2,3-Dimethoxy-9-methylene-6,8,9,13B-tetrahydro-5H-isoquino[1,2-A]isoquinoline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
307.157228918 u |
Formula |
C20H21NO2 |
InChI |
InChI=1S/C20H21NO2/c1-13-12-21-9-8-14-10-18(22-2)19(23-3)11-17(14)20(21)16-7-5-4-6-15(13)16/h4-7,10-11,20H,1,8-9,12H2,2-3H3 |
InChIKey |
PRRCYBKBJBHNMZ-UHFFFAOYSA-N |
Molecular Weight |
307.393 g/mol |
SMILES |
C12N(CCC=3C=C(C(=CC23)OC)OC)CC(C=2C=CC=CC12)=C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.882421 |