![Benzoic acid, 5-[(3-carboxy-4-hydroxy-5-methylphenyl)(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]-2-hydroxy-3-methyl-](/api/spectrum/DQKlrUbda8U/structure.png?h=300&w=458 "Benzoic acid, 5-[(3-carboxy-4-hydroxy-5-methylphenyl)(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]-2-hydroxy-3-methyl-")
| SpectraBase Compound ID | Ja5PdoyFnbw |
|---|---|
| InChI | InChI=1S/C25H20O9/c1-10-4-13(7-16(20(10)26)23(29)30)19(14-5-11(2)21(27)17(8-14)24(31)32)15-6-12(3)22(28)18(9-15)25(33)34/h4-9,26-27H,1-3H3,(H,29,30)(H,31,32)(H,33,34) |
| InChIKey | HNIYZPOKRGNVEA-UHFFFAOYSA-N |
| Mol Weight | 464.43 g/mol |
| Molecular Formula | C25H20O9 |
| Exact Mass | 464.110732 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | DQKlrUbda8U |
|---|---|
| Name | Benzoic acid, 5-[(3-carboxy-4-hydroxy-5-methylphenyl)(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]-2-hydroxy-3-methyl- |
| CAS Registry Number | 2947-64-0 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C25H20O9 |
| InChI | InChI=1S/C25H20O9/c1-10-4-13(7-16(20(10)26)23(29)30)19(14-5-11(2)21(27)17(8-14)24(31)32)15-6-12(3)22(28)18(9-15)25(33)34/h4-9,26-27H,1-3H3,(H,29,30)(H,31,32)(H,33,34) |
| InChIKey | HNIYZPOKRGNVEA-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |