SpectraBase Spectrum ID |
LNp9wbGgT7E |
Name |
4-Aminophenyl-2-[1,4-dihydroxynaphthyl]sulfone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
315.056529073 u |
Formula |
C16H13NO4S |
InChI |
InChI=1S/C16H13NO4S/c17-10-5-7-11(8-6-10)22(20,21)15-9-14(18)12-3-1-2-4-13(12)16(15)19/h1-9,18-19H,17H2 |
InChIKey |
VIHQBGAXOJMMCM-UHFFFAOYSA-N |
Molecular Weight |
315.343 g/mol |
SMILES |
C1(N)=CC=C(C=C1)S(=O)(=O)C=1C(O)=C2C=CC=CC2=C(O)C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.860281 |