| SpectraBase Spectrum ID |
CbXTsEBs6FU |
| Name |
4,5-DIHYDRO-5-OXO-1-(4-SULFOPHENYL)-1H-PYRAZOLE-3-CARBOXYLIC-ACID-TRISODIUM-SALT;ENOLATE-ANION-TAUTOMER;PYT;PYRAZOLONE-T |
| Compound Number |
2C |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C10H5N2Na3O6S |
| InChI |
InChI=1S/C10H8N2O6S.3Na/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;3*+1/p-3 |
| InChIKey |
VLQQULRYFANFQA-UHFFFAOYSA-K |
| 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 |
350.189 g/mol |
| Solvent |
D2O,PH=12 |
| Source File Reference |
UWCS18584 |
