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Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxy-2,5-cyclodien-1-ylidene)(2-sulfophenyl)methyl]-2-hydroxy-3-methyl, aluminum complex

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Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxy-2,5-cyclodien-1-ylidene)(2-sulfophenyl)methyl]-2-hydroxy-3-methyl, aluminum complex
SpectraBase Compound ID 73EbYPsXetp
InChI InChI=1S/C23H18O9S.Al/c1-11-7-13(9-15(19(11)24)21(26)27)23(14-8-12(2)20(25)16(10-14)22(28)29)17-5-3-4-6-18(17)33(30,31)32-23;/h3-10,24-25H,1-2H3,(H,26,27)(H,28,29);/q;+3/p-3
InChIKey ATXVDKQVYKGLHZ-UHFFFAOYSA-K
Mol Weight 494.41 g/mol
Molecular Formula C23H15AlO9S
Exact Mass 494.025217 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FkZqVa0UTgy
Name Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxy-2,5-cyclodien-1-ylidene)(2-sulfophenyl)methyl]-2-hydroxy-3-methyl, aluminum complex
CAS Registry Number 78301-23-2
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H15AlO9S
InChI InChI=1S/C23H18O9S.Al/c1-11-7-13(9-15(19(11)24)21(26)27)23(14-8-12(2)20(25)16(10-14)22(28)29)17-5-3-4-6-18(17)33(30,31)32-23;/h3-10,24-25H,1-2H3,(H,26,27)(H,28,29);/q;+3/p-3
InChIKey ATXVDKQVYKGLHZ-UHFFFAOYSA-K
Instrument Name Bruker IFS 85
Technique KBr-Pellet