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1-(2-Chloro-6-methyl-4-sulfophenyl)-3-methyl-5-hydroxypyrazole

View entire compound with spectra: 1 NMR, and 1 FTIR

1-(2-Chloro-6-methyl-4-sulfophenyl)-3-methyl-5-hydroxypyrazole
SpectraBase Compound ID CdzYydq1rCE
InChI InChI=1S/C11H11ClN2O4S/c1-6-3-8(19(16,17)18)5-9(12)11(6)14-10(15)4-7(2)13-14/h3-5,15H,1-2H3,(H,16,17,18)
InChIKey XJHCQKPDZABUBC-UHFFFAOYSA-N
Mol Weight 302.73 g/mol
Molecular Formula C11H11ClN2O4S
Exact Mass 302.012806 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FDu0DpBRZlG
Name 1-(2-Chloro-6-methyl-4-sulfophenyl)-3-methyl-5-hydroxypyrazole
Source of Sample Hoechst AG, Frankfurt
CAS Registry Number 6387-17-3
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H11ClN2O4S
InChI InChI=1S/C11H11ClN2O4S/c1-6-3-8(19(16,17)18)5-9(12)11(6)14-10(15)4-7(2)13-14/h3-5,15H,1-2H3,(H,16,17,18)
InChIKey XJHCQKPDZABUBC-UHFFFAOYSA-N
Instrument Name Bruker IFS 85
Synonyms Benzenesulfonic acid, 3-chloro-4-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-5-methyl- m-Toluenesulfonic acid, 5-chloro-4-(3-methyl-5-oxo-2-pyrazol
Technique KBr-Pellet