![Benzoic acid, 2-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]azo]-, disodium salt](/api/spectrum/LnpArGYtdX0/structure.png?h=300&w=458 "Benzoic acid, 2-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]azo]-, disodium salt")
| SpectraBase Compound ID | 17Boer3p6eB |
|---|---|
| InChI | InChI=1S/C17H14N4O6S.2Na/c1-10-15(19-18-14-5-3-2-4-13(14)17(23)24)16(22)21(20-10)11-6-8-12(9-7-11)28(25,26)27;;/h2-9,22H,1H3,(H,23,24)(H,25,26,27);;/q;2*+1/p-2/b19-18+;; |
| InChIKey | IZTFINKWPJXREW-BUFQOAPZSA-L |
| Mol Weight | 446.34453856 g/mol |
| Molecular Formula | C17H12N4Na2O6S |
| Exact Mass | 446.027294 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | LnpArGYtdX0 |
|---|---|
| Name | Benzoic acid, 2-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]azo]-, disodium salt |
| CAS Registry Number | 6359-83-7 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C17H12N4Na2O6S |
| InChI | InChI=1S/C17H14N4O6S.2Na/c1-10-15(19-18-14-5-3-2-4-13(14)17(23)24)16(22)21(20-10)11-6-8-12(9-7-11)28(25,26)27;;/h2-9,22H,1H3,(H,23,24)(H,25,26,27);;/q;2*+1/p-2/b19-18+;; |
| InChIKey | IZTFINKWPJXREW-BUFQOAPZSA-L |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |