SpectraBase Spectrum ID |
1LMtjflr7rG |
Name |
dof N,N-bis(3-Methoxybenzyl) |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
453.231536673 u |
Formula |
C27H32FNO4 |
InChI |
InChI=1S/C27H32FNO4/c1-19(12-22-15-27(33-5)25(28)16-26(22)32-4)29(17-20-8-6-10-23(13-20)30-2)18-21-9-7-11-24(14-21)31-3/h6-11,13-16,19H,12,17-18H2,1-5H3 |
InChIKey |
OCOQCHDHUBGUPN-UHFFFAOYSA-N |
Molecular Weight |
453.554 g/mol |
SMILES |
C=1(C(=CC(=C(C1)OC)F)OC)CC(N(CC=1C=C(C=CC1)OC)CC=1C=C(C=CC1)OC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901293 |