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2-[(3-Acetyl-5-hydroxy-1-(3-sulfophenyl)-1H-pyrazol-4-yl)diazenyl]-5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonic acid
SpectraBase Compound ID AVkH3GhkDaK
InChI InChI=1S/C20H14Cl2N8O8S2/c1-9(31)15-16(17(32)30(29-15)11-3-5-12(6-4-11)39(33,34)35)28-27-13-7-2-10(8-14(13)40(36,37)38)23-20-25-18(21)24-19(22)26-20/h2-8,32H,1H3,(H,33,34,35)(H,36,37,38)(H,23,24,25,26)/b28-27+
InChIKey OEQMHQZQEHKHQW-BYYHNAKLSA-N
Mol Weight 629.41 g/mol
Molecular Formula C20H14Cl2N8O8S2
Exact Mass 627.975307 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Hhrov2xxCqV
Name 2-[(3-Acetyl-5-hydroxy-1-(3-sulfophenyl)-1H-pyrazol-4-yl)diazenyl]-5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonic acid
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Formula C20H14Cl2N8O8S2
InChI InChI=1S/C20H14Cl2N8O8S2/c1-9(31)15-16(17(32)30(29-15)11-3-5-12(6-4-11)39(33,34)35)28-27-13-7-2-10(8-14(13)40(36,37)38)23-20-25-18(21)24-19(22)26-20/h2-8,32H,1H3,(H,33,34,35)(H,36,37,38)(H,23,24,25,26)/b28-27+
InChIKey OEQMHQZQEHKHQW-BYYHNAKLSA-N
Instrument Name Bruker IFS 85
Technique KBr-Pellet