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2,4-Dihydro-5-methyl-2-phenyl-4-(trichloroacetyl)-3H-pyrazol-3-one

View entire compound with spectra: 2 NMR, and 1 FTIR

2,4-Dihydro-5-methyl-2-phenyl-4-(trichloroacetyl)-3H-pyrazol-3-one
SpectraBase Compound ID 3M7NgySubhO
InChI InChI=1S/C12H9Cl3N2O2/c1-7-9(10(18)12(13,14)15)11(19)17(16-7)8-5-3-2-4-6-8/h2-6,9H,1H3
InChIKey VMJXYDWETXRHKD-UHFFFAOYSA-N
Mol Weight 319.58 g/mol
Molecular Formula C12H9Cl3N2O2
Exact Mass 317.972961 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FoTijRiEQM6
Name 2,4-Dihydro-5-methyl-2-phenyl-4-(trichloroacetyl)-3H-pyrazol-3-one
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 369209
CAS Registry Number 38580-17-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9Cl3N2O2
InChI InChI=1S/C12H9Cl3N2O2/c1-7-9(10(18)12(13,14)15)11(19)17(16-7)8-5-3-2-4-6-8/h2-6,9H,1H3
InChIKey VMJXYDWETXRHKD-UHFFFAOYSA-N
Observed nucleus 13C
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1-phenyl-3-methyl-4-trichloroacetyl-pyrazol-5-one 1-phenyl-3-methyl-4-trichloroacetylpyrazolone-5
Wiley ID SIAL_13CNMR_007884