![2-[(3-Acetyl-5-hydroxy-1-(3-sulfophenyl)-1H-pyrazol-4-yl)diazenyl]-5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonic acid](/api/spectrum/Hhrov2xxCqV/structure.png?h=300&w=458 "2-[(3-Acetyl-5-hydroxy-1-(3-sulfophenyl)-1H-pyrazol-4-yl)diazenyl]-5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonic acid")
| SpectraBase Compound ID | AVkH3GhkDaK |
|---|---|
| InChI | InChI=1S/C20H14Cl2N8O8S2/c1-9(31)15-16(17(32)30(29-15)11-3-5-12(6-4-11)39(33,34)35)28-27-13-7-2-10(8-14(13)40(36,37)38)23-20-25-18(21)24-19(22)26-20/h2-8,32H,1H3,(H,33,34,35)(H,36,37,38)(H,23,24,25,26)/b28-27+ |
| InChIKey | OEQMHQZQEHKHQW-BYYHNAKLSA-N |
| Mol Weight | 629.41 g/mol |
| Molecular Formula | C20H14Cl2N8O8S2 |
| Exact Mass | 627.975307 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | Hhrov2xxCqV |
|---|---|
| Name | 2-[(3-Acetyl-5-hydroxy-1-(3-sulfophenyl)-1H-pyrazol-4-yl)diazenyl]-5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonic acid |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C20H14Cl2N8O8S2 |
| InChI | InChI=1S/C20H14Cl2N8O8S2/c1-9(31)15-16(17(32)30(29-15)11-3-5-12(6-4-11)39(33,34)35)28-27-13-7-2-10(8-14(13)40(36,37)38)23-20-25-18(21)24-19(22)26-20/h2-8,32H,1H3,(H,33,34,35)(H,36,37,38)(H,23,24,25,26)/b28-27+ |
| InChIKey | OEQMHQZQEHKHQW-BYYHNAKLSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |