| SpectraBase Spectrum ID |
6ujRu7sXERM |
| Name |
N-(2-Propyl-1,2,3,4-tetrahydro-5-isoquinolyl)-3,4,5-trimethoxybenzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
384.204907386 u |
| Formula |
C22H28N2O4 |
| InChI |
InChI=1S/C22H28N2O4/c1-5-10-24-11-9-17-15(14-24)7-6-8-18(17)23-22(25)16-12-19(26-2)21(28-4)20(13-16)27-3/h6-8,12-13H,5,9-11,14H2,1-4H3,(H,23,25) |
| InChIKey |
NHCCUUKOKFWVLH-UHFFFAOYSA-N |
| Molecular Weight |
384.476 g/mol |
| SMILES |
N(C(C1=CC(=C(C(=C1)OC)OC)OC)=O)C=1C=CC=C2CN(CCC12)CCC |
| Spectrum/Structure Validation Score (Raman) |
0.975911 |
