| SpectraBase Spectrum ID |
CdVljQeq1M5 |
| Name |
1,2,3,4-Tetrahydroisoquinoline, N-acetyl-6-benzyloxy-7-methoxy-1-methyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.167793602 u |
| Formula |
C20H23NO3 |
| InChI |
InChI=1S/C20H23NO3/c1-14-18-12-19(23-3)20(24-13-16-7-5-4-6-8-16)11-17(18)9-10-21(14)15(2)22/h4-8,11-12,14H,9-10,13H2,1-3H3 |
| InChIKey |
FSPYTMFMRZUKIC-UHFFFAOYSA-N |
| Molecular Weight |
325.408 g/mol |
| SMILES |
C1(OCC2=CC=CC=C2)=CC2=C(C(N(CC2)C(=O)C)C)C=C1OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864152 |
