| SpectraBase Spectrum ID |
9XeXNscgv4A |
| Name |
5-Chloranyl-4-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-2-methoxy-phenol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.139385953 u |
| Formula |
C20H24ClNO4 |
| InChI |
InChI=1S/C20H24ClNO4/c1-4-25-18-8-12-6-7-22-20(13(12)9-19(18)26-5-2)14-10-17(24-3)16(23)11-15(14)21/h8-11,20,22-23H,4-7H2,1-3H3 |
| InChIKey |
MIOCKRHUPUDHKN-UHFFFAOYSA-N |
| Molecular Weight |
377.868 g/mol |
| SMILES |
C=1(C2C3=CC(OCC)=C(C=C3CCN2)OCC)C(=CC(=C(C1)OC)O)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927976 |
