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1H-Pyrazole-3-carboxylic acid, 4,5-dihydro-4-[[4-(6-methyl-7-sulfo-2-benzothiazolyl)phenyl]azo]-5-oxo-1-(4-sulfophenyl)-, trisodium salt
SpectraBase Compound ID 7fvv5Z5gzmF
InChI InChI=1S/C24H17N5O9S3.3Na/c1-12-2-11-17-20(21(12)41(36,37)38)39-22(25-17)13-3-5-14(6-4-13)26-27-18-19(24(31)32)28-29(23(18)30)15-7-9-16(10-8-15)40(33,34)35;;;/h2-11,30H,1H3,(H,31,32)(H,33,34,35)(H,36,37,38);;;/q;3*+1/p-3/b27-26+;;;
InChIKey OZEKQSIJYFEVRU-DTBIJOOYSA-K
Mol Weight 681.55130785 g/mol
Molecular Formula C24H14N5Na3O9S3
Exact Mass 680.964673 g/mol
Parent InChIKey QUKRLGRVNDLWLB-CYYJNZCTSA-K
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Technique KBr-Pellet
  • Dehydrothio-p-toluidinesulfonic acid->3-carboxy-1-(p-sulfophenyl)-5-pyrazolon
Unknown Identification

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