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1-(2,4-Difluorophenyl)-3-phenyl-4-(phenylselanyl)-1H-pyrazol-5-amine
SpectraBase Compound ID GMrffP25ccM
InChI InChI=1S/C21H15F2N3Se/c22-15-11-12-18(17(23)13-15)26-21(24)20(27-16-9-5-2-6-10-16)19(25-26)14-7-3-1-4-8-14/h1-13H,24H2
InChIKey YHVHYJUADZOCGC-UHFFFAOYSA-N
Mol Weight 426.34 g/mol
Molecular Formula C21H15F2N3Se
Exact Mass 427.039926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID At5ZZGEZKMr
Name 1-(2,4-Difluorophenyl)-3-phenyl-4-(phenylselanyl)-1H-pyrazol-5-amine
Appearance Brown solid
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Formula C21H15F2N3Se
InChI InChI=1S/C21H15F2N3Se/c22-15-11-12-18(17(23)13-15)26-21(24)20(27-16-9-5-2-6-10-16)19(25-26)14-7-3-1-4-8-14/h1-13H,24H2
InChIKey YHVHYJUADZOCGC-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.14.256
Molecular Weight 426.341 g/mol
Reported Formula C21H15F2N3Se
SMILES Nc1[n](nc(-c2ccccc2)c1[Se]c1ccccc1)-c1ccc(cc1F)F
SPLASH splash10-002b-0329600000-a938ade3956183fa9a47
Source of Spectrum BJO-14-SM5-4j
Wiley ID 1845753