SpectraBase Spectrum ID |
AWkaVzamaZJ |
Name |
[3,3'-Biazetidine]-2,2',4,4'-tetrone, 1,1',3,3'-tetraphenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
472.142307128 u |
Formula |
C30H20N2O4 |
InChI |
InChI=1S/C30H20N2O4/c33-25-29(21-13-5-1-6-14-21,26(34)31(25)23-17-9-3-10-18-23)30(22-15-7-2-8-16-22)27(35)32(28(30)36)24-19-11-4-12-20-24/h1-20H |
InChIKey |
JSYBYJCIHOQNQD-UHFFFAOYSA-N |
Molecular Weight |
472.500 g/mol |
SMILES |
C1(C2(C(=O)N(C2=O)C2=CC=CC=C2)C2=CC=CC=C2)(C(=O)N(C1=O)C=1C=CC=CC1)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955456 |