1-Amino-6-nitro-2-naphthol-4-sulfonic acid->1-(p-aminophenyl)-3-methyl-5-pyrazolon/phosgen.1-Naphthalenesulfonic acid, 4,4'-[carbonylbis[imino-4,1-phenylene(4,5-dihydro-3-methyl-5-oxo-1H-pyrazole-1,4-diyl)azo]]bis[3-hydroxy-7-nitro-, disodium salt

SpectraBase Compound ID	L0jGp6bIfZH
InChI	InChI=1S/C41H30N12O15S2.2Na/c1-19-35(44-46-37-27-13-11-25(52(59)60)15-29(27)33(17-31(37)54)69(63,64)65)39(56)50(48-19)23-7-3-21(4-8-23)42-41(58)43-22-5-9-24(10-6-22)51-40(57)36(20(2)49-51)45-47-38-28-14-12-26(53(61)62)16-30(28)34(18-32(38)55)70(66,67)68;;/h3-18,54-57H,1-2H3,(H2,42,43,58)(H,63,64,65)(H,66,67,68);;/q;2*+1/p-2/b46-44-,47-45-;;
InChIKey	ZBJZMLDPFHVBEW-KRVMIEOPSA-L Google Search
Mol Weight	1038.84353856 g/mol
Molecular Formula	C41H28N12Na2O15S2
Exact Mass	1038.103389 g/mol

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SpectraBase Spectrum ID	8z933XPXNUA
Name	1-Amino-6-nitro-2-naphthol-4-sulfonic acid->1-(p-aminophenyl)-3-methyl-5-pyrazolon/phosgen.1-Naphthalenesulfonic acid, 4,4'-[carbonylbis[imino-4,1-phenylene(4,5-dihydro-3-methyl-5-oxo-1H-pyrazole-1,4-diyl)azo]]bis[3-hydroxy-7-nitro-, disodium salt
CAS Registry Number	6410-47-5
Copyright	Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C41H28N12Na2O15S2
InChI	InChI=1S/C41H30N12O15S2.2Na/c1-19-35(44-46-37-27-13-11-25(52(59)60)15-29(27)33(17-31(37)54)69(63,64)65)39(56)50(48-19)23-7-3-21(4-8-23)42-41(58)43-22-5-9-24(10-6-22)51-40(57)36(20(2)49-51)45-47-38-28-14-12-26(53(61)62)16-30(28)34(18-32(38)55)70(66,67)68;;/h3-18,54-57H,1-2H3,(H2,42,43,58)(H,63,64,65)(H,66,67,68);;/q;2*+1/p-2/b46-44-,47-45-;;
InChIKey	ZBJZMLDPFHVBEW-KRVMIEOPSA-L
Instrument Name	Bruker IFS 85
Technique	KBr-Pellet