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4-(4'-Methoxybenzoyl)-1-methyl-5-hydroxy-3-(trifluoromethyl)pyrazole
SpectraBase Compound ID Gif01jJyzax
InChI InChI=1S/C13H11F3N2O3/c1-18-12(20)9(11(17-18)13(14,15)16)10(19)7-3-5-8(21-2)6-4-7/h3-6,20H,1-2H3
InChIKey UKNQKJGORCDGOH-UHFFFAOYSA-N
Mol Weight 300.24 g/mol
Molecular Formula C13H11F3N2O3
Exact Mass 300.072177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DhRT05ZZKoO
Name 4-(4'-Methoxybenzoyl)-1-methyl-5-hydroxy-3-(trifluoromethyl)pyrazole
Alternate Name(s) [5-hydroxy-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl](4-methoxyphenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11F3N2O3
InChI InChI=1S/C13H11F3N2O3/c1-18-12(20)9(11(17-18)13(14,15)16)10(19)7-3-5-8(21-2)6-4-7/h3-6,20H,1-2H3
InChIKey UKNQKJGORCDGOH-UHFFFAOYSA-N
Molecular Weight 300.237 g/mol
SMILES Oc1c(c(n[n]1C)C(F)(F)F)C(c1ccc(cc1)OC)=O
SPLASH splash10-0a4i-0900000000-84a1eca0bb8d4358f9bf
Source of Spectrum SK-28-2164-6
Wiley ID 868551