| SpectraBase Spectrum ID |
Js4qJFsVQSR |
| Name |
N-Methyl-4-benzyloxy-3-methoxyphenethylamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
329.162708221 u |
| Formula |
C19H23NO4 |
| InChI |
InChI=1S/C19H23NO4/c1-3-23-19(21)20-12-11-15-9-10-17(18(13-15)22-2)24-14-16-7-5-4-6-8-16/h4-10,13H,3,11-12,14H2,1-2H3,(H,20,21) |
| InChIKey |
INHXBNUEEZIHNJ-UHFFFAOYSA-N |
| Molecular Weight |
329.396 g/mol |
| SMILES |
C(=O)(NCCC=1C=C(OC)C(=CC1)OCC=1C=CC=CC1)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969946 |