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3,5-bis(4-chlorophenyl)-1-(4-iodophenyl)-1H-pyrazole
SpectraBase Compound ID MeK6ZcpvSs
InChI InChI=1S/C21H13Cl2IN2/c22-16-5-1-14(2-6-16)20-13-21(15-3-7-17(23)8-4-15)26(25-20)19-11-9-18(24)10-12-19/h1-13H
InChIKey KWNDLJRTQUJYLG-UHFFFAOYSA-N
Mol Weight 491.16 g/mol
Molecular Formula C21H13Cl2IN2
Exact Mass 489.950049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4N9XCYemLA
Name 3,5-bis(4-chlorophenyl)-1-(4-iodophenyl)-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H13Cl2IN2
InChI InChI=1S/C21H13Cl2IN2/c22-16-5-1-14(2-6-16)20-13-21(15-3-7-17(23)8-4-15)26(25-20)19-11-9-18(24)10-12-19/h1-13H
InChIKey KWNDLJRTQUJYLG-UHFFFAOYSA-N
Molecular Weight 491.159 g/mol
SMILES c1cc(-[n]2nc(-c3ccc(cc3)Cl)cc2-c2ccc(cc2)Cl)ccc1I
SPLASH splash10-0006-9412200000-66e236d6316734fad207
Wiley ID 1437422