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1-(4-Chloro-2,3,5,6-tetrafluoro)phenyl-3-isobutyl-5-cyano-4,5-dihydropyrazole
SpectraBase Compound ID 4PqH47pIdsy
InChI InChI=1S/C14H12ClF4N3/c1-6(2)3-7-4-8(5-20)22(21-7)14-12(18)10(16)9(15)11(17)13(14)19/h6,8H,3-4H2,1-2H3
InChIKey NWUCHEJCDLTPPV-UHFFFAOYSA-N
Mol Weight 333.72 g/mol
Molecular Formula C14H12ClF4N3
Exact Mass 333.065588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CHVjvGP1rvk
Name 1-(4-Chloro-2,3,5,6-tetrafluoro)phenyl-3-isobutyl-5-cyano-4,5-dihydropyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12ClF4N3
InChI InChI=1S/C14H12ClF4N3/c1-6(2)3-7-4-8(5-20)22(21-7)14-12(18)10(16)9(15)11(17)13(14)19/h6,8H,3-4H2,1-2H3
InChIKey NWUCHEJCDLTPPV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.20020201121
Molecular Weight 333.718 g/mol
SMILES C1(=NN(C(C1)C#N)c1c(c(c(c(c1F)F)Cl)F)F)CC(C)C
SPLASH splash10-0006-2595000000-f9025c5dec2e2598cf53
Source of Spectrum CJC-20-1278-3j
Synonyms 1-(4-Chloro-2,3,5,6-tetrafluorophenyl)-3-isobutyl-4,5-dihydro-1H-pyrazole-5-carbonitrile
Wiley ID 1774778