SpectraBase Spectrum ID |
947054Uvhu1 |
Name |
bis[4-[m-Hydroxyanilino]-3-nitrophenyl]sulfone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
522.084534722 u |
Formula |
C24H18N4O8S |
InChI |
InChI=1S/C24H18N4O8S/c29-17-5-1-3-15(11-17)25-21-9-7-19(13-23(21)27(31)32)37(35,36)20-8-10-22(24(14-20)28(33)34)26-16-4-2-6-18(30)12-16/h1-14,25-26,29-30H |
InChIKey |
JMTGLHVPHXSUEK-UHFFFAOYSA-N |
Molecular Weight |
522.488 g/mol |
SMILES |
C1=C(C=C(C=C1)NC1=C(C=C(C=C1)S(=O)(=O)C1=CC=C(C(=C1)N(=O)=O)NC1=CC=CC(=C1)O)N(=O)=O)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878085 |