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4-((4-Chlorophenyl)selanyl)-1,3-diphenyl-1H-pyrazol-5-amine
SpectraBase Compound ID 9fZw6wnXMO8
InChI InChI=1S/C21H16ClN3Se/c22-16-11-13-18(14-12-16)26-20-19(15-7-3-1-4-8-15)24-25(21(20)23)17-9-5-2-6-10-17/h1-14H,23H2
InChIKey PWCBCPVGCSCSBW-UHFFFAOYSA-N
Mol Weight 424.8 g/mol
Molecular Formula C21H16ClN3Se
Exact Mass 425.019797 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLvl16gK32F
Name 4-((4-Chlorophenyl)selanyl)-1,3-diphenyl-1H-pyrazol-5-amine
Appearance Reddish solid
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Formula C21H16ClN3Se
InChI InChI=1S/C21H16ClN3Se/c22-16-11-13-18(14-12-16)26-20-19(15-7-3-1-4-8-15)24-25(21(20)23)17-9-5-2-6-10-17/h1-14H,23H2
InChIKey PWCBCPVGCSCSBW-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.14.256
Molecular Weight 424.805 g/mol
Reported Formula C21H16ClN3Se
SMILES Nc1[n](nc(-c2ccccc2)c1[Se]c1ccc(cc1)Cl)-c1ccccc1
SPLASH splash10-002b-0119300000-dc13a04bbf3b5c7dc412
Source of Spectrum BJO-14-SM6-4n
Wiley ID 1845756