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Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)(2-chloro-4-nitrophenyl)methyl]-2-hydroxy-3-methyl-, disodium salt

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Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)(2-chloro-4-nitrophenyl)methyl]-2-hydroxy-3-methyl-, disodium salt
SpectraBase Compound ID E9CcwBOlK6j
InChI InChI=1S/C23H16ClNO8.2Na/c1-10-5-12(7-16(20(10)26)22(28)29)19(15-4-3-14(25(32)33)9-18(15)24)13-6-11(2)21(27)17(8-13)23(30)31;;/h3-9,26H,1-2H3,(H,28,29)(H,30,31);;/q;2*+1/p-2/b19-13-;;
InChIKey XTYIXFCABNMIFY-SJNXHXLPSA-L
Mol Weight 513.79653856 g/mol
Molecular Formula C23H14ClNNa2O8
Exact Mass 513.020333 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID AqvSCynqbmD
Name Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)(2-chloro-4-nitrophenyl)methyl]-2-hydroxy-3-methyl-, disodium salt
CAS Registry Number 10143-02-9
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H14ClNNa2O8
InChI InChI=1S/C23H16ClNO8.2Na/c1-10-5-12(7-16(20(10)26)22(28)29)19(15-4-3-14(25(32)33)9-18(15)24)13-6-11(2)21(27)17(8-13)23(30)31;;/h3-9,26H,1-2H3,(H,28,29)(H,30,31);;/q;2*+1/p-2/b19-13-;;
InChIKey XTYIXFCABNMIFY-SJNXHXLPSA-L
Instrument Name Bruker IFS 85
Technique KBr-Pellet