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3-(4'-Fluorophenyl)-1-(p-nitrophenyl)-4-(p'-methylphenyl)-1H-pyrazole-5-carbonitrile
SpectraBase Compound ID LCbqLSnWbkd
InChI InChI=1S/C23H15FN4O2/c1-15-2-4-16(5-3-15)22-21(14-25)27(19-10-12-20(13-11-19)28(29)30)26-23(22)17-6-8-18(24)9-7-17/h2-13H,1H3
InChIKey XYMYVKFRYPAJQJ-UHFFFAOYSA-N
Mol Weight 398.4 g/mol
Molecular Formula C23H15FN4O2
Exact Mass 398.117904 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BpZfbaDnjhh
Name 3-(4'-Fluorophenyl)-1-(p-nitrophenyl)-4-(p'-methylphenyl)-1H-pyrazole-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H15FN4O2
InChI InChI=1S/C23H15FN4O2/c1-15-2-4-16(5-3-15)22-21(14-25)27(19-10-12-20(13-11-19)28(29)30)26-23(22)17-6-8-18(24)9-7-17/h2-13H,1H3
InChIKey XYMYVKFRYPAJQJ-UHFFFAOYSA-N
Molecular Weight 398.397 g/mol
SMILES c1([n](nc(c1-c1ccc(cc1)C)-c1ccc(cc1)F)-c1ccc(N(=O)=O)cc1)C#N
SPLASH splash10-0002-1009000000-92497ca1ce8cfd27f230
Source of Spectrum D9-20-976-8b
Wiley ID 1695494