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1H-Pyrazole-1-butanamide, N-[4-chloro-3-(trifluoromethyl)phenyl]-4-nitro-
SpectraBase Compound ID 7l70HivlfPC
InChI InChI=1S/C14H12ClF3N4O3/c15-12-4-3-9(6-11(12)14(16,17)18)20-13(23)2-1-5-21-8-10(7-19-21)22(24)25/h3-4,6-8H,1-2,5H2,(H,20,23)
InChIKey RCPSKUXRJSVUAU-UHFFFAOYSA-N
Mol Weight 376.72 g/mol
Molecular Formula C14H12ClF3N4O3
Exact Mass 376.055002 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7pqrgngYl4L
Name 1H-Pyrazole-1-butanamide, N-[4-chloro-3-(trifluoromethyl)phenyl]-4-nitro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12ClF3N4O3
InChI InChI=1S/C14H12ClF3N4O3/c15-12-4-3-9(6-11(12)14(16,17)18)20-13(23)2-1-5-21-8-10(7-19-21)22(24)25/h3-4,6-8H,1-2,5H2,(H,20,23)
InChIKey RCPSKUXRJSVUAU-UHFFFAOYSA-N
Molecular Weight 376.723 g/mol
SMILES N(C(CCC[n]1cc(N(=O)=O)cn1)=O)c1cc(C(F)(F)F)c(cc1)Cl
SPLASH splash10-001i-6900000000-ef118162db54124b3a0d
Source of Spectrum IY-1-4644-9
Synonyms N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(4-nitro-1-pyrazolyl)butanamide N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(4-nitropyrazol-1-yl)butanamide N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-(4-nitropyrazol-1-yl)butanamide
Wiley ID 1654432