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Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[4-[(4-methylphenyl)amino]phenyl]methyl]-2-hydroxy-3-methyl-, disodium salt
SpectraBase Compound ID 6ECUV2argYK
InChI InChI=1S/C30H25NO6.2Na/c1-16-4-8-22(9-5-16)31-23-10-6-19(7-11-23)26(20-12-17(2)27(32)24(14-20)29(34)35)21-13-18(3)28(33)25(15-21)30(36)37;;/h4-15,31-32H,1-3H3,(H,34,35)(H,36,37);;/q;2*+1/p-2/b26-21-;;
InChIKey AUYVGJUPCLMISU-CXJWIYSGSA-L
Mol Weight 539.49453856 g/mol
Molecular Formula C30H23NNa2O6
Exact Mass 539.132076 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9nhJcQABtTs
Name Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[4-[(4-methylphenyl)amino]phenyl]methyl]-2-hydroxy-3-methyl-, disodium salt
CAS Registry Number 5852-33-5
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C30H23NNa2O6
InChI InChI=1S/C30H25NO6.2Na/c1-16-4-8-22(9-5-16)31-23-10-6-19(7-11-23)26(20-12-17(2)27(32)24(14-20)29(34)35)21-13-18(3)28(33)25(15-21)30(36)37;;/h4-15,31-32H,1-3H3,(H,34,35)(H,36,37);;/q;2*+1/p-2/b26-21-;;
InChIKey AUYVGJUPCLMISU-CXJWIYSGSA-L
Instrument Name Bruker IFS 85
Technique KBr-Pellet