SpectraBase Spectrum ID |
CMI09NIfHxG |
Name |
2-(3-Methoxy-4-phenylmethoxy-phenyl)-2-(4-phenylmethoxyphenyl)ethanamine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
439.214743795 u |
Formula |
C29H29NO3 |
InChI |
InChI=1S/C29H29NO3/c1-31-29-18-25(14-17-28(29)33-21-23-10-6-3-7-11-23)27(19-30)24-12-15-26(16-13-24)32-20-22-8-4-2-5-9-22/h2-18,27H,19-21,30H2,1H3 |
InChIKey |
QFTDOMBOLBJPQQ-UHFFFAOYSA-N |
Molecular Weight |
439.555 g/mol |
SMILES |
C(C(C=1C=CC(=CC1)OCC=1C=CC=CC1)C=1C=C(C(=CC1)OCC=1C=CC=CC1)OC)N |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89072 |