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3-Methyl-1-phenyl-4-(N-acetylamido-2-trichloroethyl)-2-pyrazoline-5-one
SpectraBase Compound ID HrY7JypZygM
InChI InChI=1S/C14H14Cl3N3O2/c1-8-11(12(14(15,16)17)18-9(2)21)13(22)20(19-8)10-6-4-3-5-7-10/h3-7,11-12H,1-2H3,(H,18,21)
InChIKey XUGLJOPWBSXNND-UHFFFAOYSA-N
Mol Weight 362.64 g/mol
Molecular Formula C14H14Cl3N3O2
Exact Mass 361.01516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6N4n0AUXQy0
Name 3-Methyl-1-phenyl-4-(N-acetylamido-2-trichloroethyl)-2-pyrazoline-5-one
Alternate Name(s) N-[2,2,2-trichloro-1-(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)ethyl]acetamide N-[2,2,2-tris(chloranyl)-1-(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)ethyl]ethanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14Cl3N3O2
InChI InChI=1S/C14H14Cl3N3O2/c1-8-11(12(14(15,16)17)18-9(2)21)13(22)20(19-8)10-6-4-3-5-7-10/h3-7,11-12H,1-2H3,(H,18,21)
InChIKey XUGLJOPWBSXNND-UHFFFAOYSA-N
Molecular Weight 362.644 g/mol
SMILES N(C(C1C(N(N=C1C)c1ccccc1)=O)C(Cl)(Cl)Cl)C(=O)C
SPLASH splash10-006x-9300000000-373069ca6061aa05adc3
Source of Spectrum SO-0-494-3
Wiley ID 1539323