| SpectraBase Spectrum ID |
LS6NOnh65Ii |
| Name |
6-Methyl-5,7,8-trimethoxy-1-phthalimidomethyl-1,2,3,4-tetrahydroisoquinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.168521876 u |
| Formula |
C22H24N2O5 |
| InChI |
InChI=1S/C22H24N2O5/c1-12-18(27-2)15-9-10-23-16(17(15)20(29-4)19(12)28-3)11-24-21(25)13-7-5-6-8-14(13)22(24)26/h5-8,16,23H,9-11H2,1-4H3 |
| InChIKey |
BXHACAMFBBIXEN-UHFFFAOYSA-N |
| Molecular Weight |
396.443 g/mol |
| SMILES |
C1(NCCC=2C(=C(C(=C(C12)OC)OC)C)OC)CN1C(=O)C=2C(C1=O)=CC=CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95177 |
