| SpectraBase Spectrum ID |
35JF3K23WYm |
| Name |
1-(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)ethan-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
249.136493473 u |
| Formula |
C14H19NO3 |
| InChI |
InChI=1S/C14H19NO3/c1-9(16)14-11-8-13(18-4)12(17-3)7-10(11)5-6-15(14)2/h7-8,14H,5-6H2,1-4H3 |
| InChIKey |
ZHGKAYJNVHMRFO-UHFFFAOYSA-N |
| Molecular Weight |
249.310 g/mol |
| SMILES |
C1(=C(C=C2C(=C1)C(N(C)CC2)C(=O)C)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950531 |
