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3-[(2-Hydroxy-4-tolyl)diazeny]-1-phenyl-4-[(4-(hydroxysulfonyl)phenyl)diazonyl]-1H-pyrazol-5-ol
SpectraBase Compound ID AorOvudKpFR
InChI InChI=1S/C22H18N6O5S/c1-14-7-12-18(19(29)13-14)24-26-21-20(22(30)28(27-21)16-5-3-2-4-6-16)25-23-15-8-10-17(11-9-15)34(31,32)33/h2-13,29-30H,1H3,(H,31,32,33)/b25-23+,26-24+
InChIKey DOLNQEHXBKUZHJ-OGGGYYITSA-N
Mol Weight 478.48 g/mol
Molecular Formula C22H18N6O5S
Exact Mass 478.105939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bcax1dJuC8
Name 3-[(2-Hydroxy-4-tolyl)diazeny]-1-phenyl-4-[(4-(hydroxysulfonyl)phenyl)diazonyl]-1H-pyrazol-5-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18N6O5S
InChI InChI=1S/C22H18N6O5S/c1-14-7-12-18(19(29)13-14)24-26-21-20(22(30)28(27-21)16-5-3-2-4-6-16)25-23-15-8-10-17(11-9-15)34(31,32)33/h2-13,29-30H,1H3,(H,31,32,33)/b25-23+,26-24+
InChIKey DOLNQEHXBKUZHJ-OGGGYYITSA-N
Literature Reference DOI 10.1002/cjoc.200990227
Molecular Weight 478.483 g/mol
SMILES Oc1[n](nc(c1\N=N\c1ccc(S(=O)(=O)O)cc1)\N=N\c1ccc(cc1O)C)-c1ccccc1
SPLASH splash10-004i-1190500000-0ae693b72515789d2ccf
Source of Spectrum CJC-27-1363-7b
Synonyms 4-((E)-(5-hydroxy-3-((E)-(2-hydroxy-4-methylphenyl)diazenyl)-1-phenyl-1H-pyrazol-4-yl)diazenyl)benzenesulfonic acid
Wiley ID 1772334