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(E)-5-(Allylideneamino)-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-1H-pyrazole-3-carbonitrile
SpectraBase Compound ID LxUgGsnVZ9g
InChI InChI=1S/C14H7Cl2F3N4/c1-2-3-21-12-6-9(7-20)22-23(12)13-10(15)4-8(5-11(13)16)14(17,18)19/h2-6H,1H2/b21-3+
InChIKey ROGZBWZNKYVUDX-WSVFEZOKSA-N
Mol Weight 359.14 g/mol
Molecular Formula C14H7Cl2F3N4
Exact Mass 357.999986 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GyMSelldtfH
Name (E)-5-(Allylideneamino)-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-1H-pyrazole-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H7Cl2F3N4
InChI InChI=1S/C14H7Cl2F3N4/c1-2-3-21-12-6-9(7-20)22-23(12)13-10(15)4-8(5-11(13)16)14(17,18)19/h2-6H,1H2/b21-3+
InChIKey ROGZBWZNKYVUDX-WSVFEZOKSA-N
Instrument Name MicroMass GCT CA 055
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.224
Molecular Weight 359.139 g/mol
Reported Formula C14H7Cl2F3N4
SMILES C(\C=N\c1cc(n[n]1-c1c(cc(cc1Cl)C(F)(F)F)Cl)C#N)=C
SPLASH splash10-00di-1192000000-1e94b1fcb91b635b56ad
Source of Spectrum ARK-2009-263-8
Wiley ID 1866632