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p-[(3,4-DICHLORO-1-METHYLPYRAZOL-5-YL)OXY]BENZENESULFONIC ACID, PHENYL ESTER

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

p-[(3,4-DICHLORO-1-METHYLPYRAZOL-5-YL)OXY]BENZENESULFONIC ACID, PHENYL ESTER
SpectraBase Compound ID KjcySCTVtab
InChI InChI=1S/C16H12Cl2N2O4S/c1-20-16(14(17)15(18)19-20)23-11-7-9-13(10-8-11)25(21,22)24-12-5-3-2-4-6-12/h2-10H,1H3
InChIKey IFPYVFOYMCZXIA-UHFFFAOYSA-N
Mol Weight 399.25 g/mol
Molecular Formula C16H12Cl2N2O4S
Exact Mass 397.989483 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ByWwq6DvKN3
Name p-[(3,4-DICHLORO-1-METHYLPYRAZOL-5-YL)OXY]BENZENESULFONIC ACID, PHENYL ESTER
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12Cl2N2O4S
InChI InChI=1S/C16H12Cl2N2O4S/c1-20-16(14(17)15(18)19-20)23-11-7-9-13(10-8-11)25(21,22)24-12-5-3-2-4-6-12/h2-10H,1H3
InChIKey IFPYVFOYMCZXIA-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 91-93C
Molecular Weight 399.25
Solvent CDCl3; Reference=TMS; Temperature 297K