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Ethyl 1-Phenyl-3-{[(trifluoromethyl)sulfonyl]oxy}-1H-pyrazole-4-carboxylate
SpectraBase Compound ID 4fGGu2rd9Ds
InChI InChI=1S/C13H11F3N2O5S/c1-2-22-12(19)10-8-18(9-6-4-3-5-7-9)17-11(10)23-24(20,21)13(14,15)16/h3-8H,2H2,1H3
InChIKey TWTXIWDYHYZPFH-UHFFFAOYSA-N
Mol Weight 364.3 g/mol
Molecular Formula C13H11F3N2O5S
Exact Mass 364.034077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GGUYXQjFg
Name Ethyl 1-Phenyl-3-{[(trifluoromethyl)sulfonyl]oxy}-1H-pyrazole-4-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11F3N2O5S
InChI InChI=1S/C13H11F3N2O5S/c1-2-22-12(19)10-8-18(9-6-4-3-5-7-9)17-11(10)23-24(20,21)13(14,15)16/h3-8H,2H2,1H3
InChIKey TWTXIWDYHYZPFH-UHFFFAOYSA-N
Molecular Weight 364.295 g/mol
SMILES c1(c(c[n](n1)-c1ccccc1)C(=O)OCC)OS(C(F)(F)F)(=O)=O
SPLASH splash10-003r-9052000000-1f2e075bf7ae888efb41
Source of Spectrum U1-2011-1884-5
Synonyms 1-Phenyl-3-(trifluoromethylsulfonyloxy)-4-pyrazolecarboxylic acid ethyl ester Ethyl 1-phenyl-3-(trifluoromethylsulfonyloxy)pyrazole-4-carboxylate
Wiley ID 1665078