| SpectraBase Compound ID | 6fHLTRVSvfE |
|---|---|
| InChI | InChI=1S/C16H12Cl2N4O7S2.2Na/c1-8-15(20-19-9-2-4-10(5-3-9)30(24,25)26)16(23)22(21-8)13-6-12(18)14(7-11(13)17)31(27,28)29;;/h2-7,23H,1H3,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2/b20-19+;; |
| InChIKey | QWSQBPVXJFWXDW-LLIZZRELSA-L |
| Mol Weight | 551.28253856 g/mol |
| Molecular Formula | C16H10Cl2N4Na2O7S2 |
| Exact Mass | 549.916335 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 2sMsiJIWY26 |
|---|---|
| Name | Sulfanilic acid->1-(2,5-dichloro-4-sulfophenyl)-3-methyl-5-pyrazolon |
| CAS Registry Number | 6359-98-4 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C16H10Cl2N4Na2O7S2 |
| InChI | InChI=1S/C16H12Cl2N4O7S2.2Na/c1-8-15(20-19-9-2-4-10(5-3-9)30(24,25)26)16(23)22(21-8)13-6-12(18)14(7-11(13)17)31(27,28)29;;/h2-7,23H,1H3,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2/b20-19+;; |
| InChIKey | QWSQBPVXJFWXDW-LLIZZRELSA-L |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |