SpectraBase Spectrum ID |
5TTMiaB3bb7 |
Name |
4',4'''-bi-o-benzotoluidide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
420.183778019 u |
Formula |
C28H24N2O2 |
InChI |
InChI=1S/C28H24N2O2/c1-19-17-23(13-15-25(19)29-27(31)21-9-5-3-6-10-21)24-14-16-26(20(2)18-24)30-28(32)22-11-7-4-8-12-22/h3-18H,1-2H3,(H,29,31)(H,30,32) |
InChIKey |
CYXZKOOWPBQZJB-UHFFFAOYSA-N |
Molecular Weight |
420.512 g/mol |
SMILES |
C1=C(C=C(C(=C1)NC(=O)C1=CC=CC=C1)C)C1=CC=C(NC(=O)C2=CC=CC=C2)C(=C1)C |