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1-(2,6-Dichloro-4-(trifluoromethyl)phenyl)-5-((E)-((E)-3-phenylallylidene)amino)-1H-pyrazole-3-carbonitrile
SpectraBase Compound ID HXRE9KtB1N1
InChI InChI=1S/C20H11Cl2F3N4/c21-16-9-14(20(23,24)25)10-17(22)19(16)29-18(11-15(12-26)28-29)27-8-4-7-13-5-2-1-3-6-13/h1-11H/b7-4+,27-8+
InChIKey NHJLIWQUNGRRIA-JSAVROBTSA-N
Mol Weight 435.24 g/mol
Molecular Formula C20H11Cl2F3N4
Exact Mass 434.031286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PJ3F7izpdd
Name 1-(2,6-Dichloro-4-(trifluoromethyl)phenyl)-5-((E)-((E)-3-phenylallylidene)amino)-1H-pyrazole-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H11Cl2F3N4
InChI InChI=1S/C20H11Cl2F3N4/c21-16-9-14(20(23,24)25)10-17(22)19(16)29-18(11-15(12-26)28-29)27-8-4-7-13-5-2-1-3-6-13/h1-11H/b7-4+,27-8+
InChIKey NHJLIWQUNGRRIA-JSAVROBTSA-N
Instrument Name MicroMass GCT CA 055
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.224
Molecular Weight 435.237 g/mol
Reported Formula C20H11F3Cl2N4
SMILES c1(Cl)cc(cc(c1-[n]1nc(cc1\N=C\C=C\c1ccccc1)C#N)Cl)C(F)(F)F
SPLASH splash10-0159-0900700000-2281166614c2e24b0cb9
Source of Spectrum ARK-2009-264-13
Wiley ID 1866617