| SpectraBase Spectrum ID |
1o6L77ihcKa |
| Name |
Methanone, (3,4-dimethoxyphenyl)(1,2,3,4-tetrahydro-3-isoquinolinyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
297.136493473 u |
| Formula |
C18H19NO3 |
| InChI |
InChI=1S/C18H19NO3/c1-21-16-8-7-13(10-17(16)22-2)18(20)15-9-12-5-3-4-6-14(12)11-19-15/h3-8,10,15,19H,9,11H2,1-2H3 |
| InChIKey |
ZKZFBELTYDHRGB-UHFFFAOYSA-N |
| Molecular Weight |
297.354 g/mol |
| SMILES |
C1(NCC2=C(C1)C=CC=C2)C(C=1C=C(OC)C(=CC1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953028 |
