Bio-Rad Laboratories, Inc. SpectraBase; SpectraBase Compound ID=ePy0ZfG1qb SpectraBase Spectrum ID=EPIj9WPnshX
http://spectrabase.com/spectrum/EPIj9WPnshX (accessed Nov 17, 2019).

4,5-DIHYDRO-5-OXO-1-(4-SULFOPHENYL)-1H-PYRAZOLE-3-CARBOXYLIC-ACID-DISODIUM-SALT;ENOL-TAUTOMER;PYT;PYRAZOLONE-T
SpectraBase Compound ID ePy0ZfG1qb
InChI InChI=1S/C10H8N2O6S.2Na/c13-9-5-8(10(14)15)11-12(9)6-1-3-7(4-2-6)19(16,17)18;;/h1-5,13H,(H,14,15)(H,16,17,18);;/q;2*+1/p-2
InChIKey BZKSGFDVNKLTOV-UHFFFAOYSA-L
Mol Weight 328.20553856 g/mol
Molecular Formula C10H6N2Na2O6S
Exact Mass 327.974197 g/mol

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SpectraBase Spectrum ID EPIj9WPnshX
SpectraBase Batch ID E5pFlEKWVUA
Name 4,5-DIHYDRO-5-OXO-1-(4-SULFOPHENYL)-1H-PYRAZOLE-3-CARBOXYLIC-ACID-DISODIUM-SALT;ENOL-TAUTOMER;PYT;PYRAZOLONE-T
Compound Number 2B
Copyright Copyright © 2016 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H6N2Na2O6S
InChI InChI=1S/C10H8N2O6S.2Na/c13-9-5-8(10(14)15)11-12(9)6-1-3-7(4-2-6)19(16,17)18;;/h1-5,13H,(H,14,15)(H,16,17,18);;/q;2*+1/p-2
InChIKey BZKSGFDVNKLTOV-UHFFFAOYSA-L
Literature Reference Author S.J.BELL,E.P.MAZZOLA,M.J.DINOVI,W.F.REYNOLDS,K.W.NIELSEN
Literature Reference Citation J.HETCYCL.CHEM.,28,641(1991)
Literature Reference DOI 10.1002/jhet.5570280318
Molecular Weight 328.207 g/mol
Solvent D2O;PH=2.2
Source File Reference UWCS18582