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1H-Pyrazole-1-butanamide, N-[2-chloro-5-(trifluoromethyl)phenyl]-3,5-dimethyl-4-nitro-
SpectraBase Compound ID FCqfkGSOFNi
InChI InChI=1S/C16H16ClF3N4O3/c1-9-15(24(26)27)10(2)23(22-9)7-3-4-14(25)21-13-8-11(16(18,19)20)5-6-12(13)17/h5-6,8H,3-4,7H2,1-2H3,(H,21,25)
InChIKey UMCNPZIVWBKMCP-UHFFFAOYSA-N
Mol Weight 404.78 g/mol
Molecular Formula C16H16ClF3N4O3
Exact Mass 404.086303 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzpAC7Xw1xi
Name 1H-Pyrazole-1-butanamide, N-[2-chloro-5-(trifluoromethyl)phenyl]-3,5-dimethyl-4-nitro-
Alternate Name(s) N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(3,5-dimethyl-4-nitro-1-pyrazolyl)butanamide N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(3,5-dimethyl-4-nitropyrazol-1-yl)butanamide N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide N-[2-chloranyl-5-(trifluoromethyl)phenyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16ClF3N4O3
InChI InChI=1S/C16H16ClF3N4O3/c1-9-15(24(26)27)10(2)23(22-9)7-3-4-14(25)21-13-8-11(16(18,19)20)5-6-12(13)17/h5-6,8H,3-4,7H2,1-2H3,(H,21,25)
InChIKey UMCNPZIVWBKMCP-UHFFFAOYSA-N
Molecular Weight 404.777 g/mol
SMILES N(c1cc(ccc1Cl)C(F)(F)F)C(=O)CCC[n]1nc(c(c1C)N(=O)=O)C
SPLASH splash10-02tc-7930000000-9ed4dca1f6902912d4ff
Source of Spectrum IY-1-4588-8
Wiley ID 1653871