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4-Bromo-5-[benzoyloxy]-1-methyl-3-(trifluoromethyl)pyrazole
SpectraBase Compound ID C0O8LphL9oU
InChI InChI=1S/C12H8BrF3N2O2/c1-18-10(8(13)9(17-18)12(14,15)16)20-11(19)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey SHHQTRFBRBXVOW-UHFFFAOYSA-N
Mol Weight 349.11 g/mol
Molecular Formula C12H8BrF3N2O2
Exact Mass 347.972125 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5a9NFS6aXbV
Name 4-Bromo-5-[benzoyloxy]-1-methyl-3-(trifluoromethyl)pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8BrF3N2O2
InChI InChI=1S/C12H8BrF3N2O2/c1-18-10(8(13)9(17-18)12(14,15)16)20-11(19)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey SHHQTRFBRBXVOW-UHFFFAOYSA-N
Molecular Weight 349.107 g/mol
SMILES c1(c(c(C(F)(F)F)n[n]1C)Br)OC(=O)c1ccccc1
SPLASH splash10-0a6r-4900000000-cf3af0f27dde4d706634
Source of Spectrum SK-28-2164-5c
Synonyms benzoic acid [4-bromo-2-methyl-5-(trifluoromethyl)-3-pyrazolyl] ester [4-bromo-2-methyl-5-(trifluoromethyl)pyrazol-3-yl] benzoate [4-bromanyl-2-methyl-5-(trifluoromethyl)pyrazol-3-yl] benzoate
Wiley ID 868553