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3-(4'-Fluorophenyl)-1-(p-nitrophenyl)-4-(p'-methoxyphenyl)-1H-pyrazole-5-carbonitrile
SpectraBase Compound ID Hd5U8xENq85
InChI InChI=1S/C23H15FN4O3/c1-31-20-12-4-15(5-13-20)22-21(14-25)27(18-8-10-19(11-9-18)28(29)30)26-23(22)16-2-6-17(24)7-3-16/h2-13H,1H3
InChIKey ONDZLVMNWRBMCP-UHFFFAOYSA-N
Mol Weight 414.4 g/mol
Molecular Formula C23H15FN4O3
Exact Mass 414.112819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D14BG39QwGL
Name 3-(4'-Fluorophenyl)-1-(p-nitrophenyl)-4-(p'-methoxyphenyl)-1H-pyrazole-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H15FN4O3
InChI InChI=1S/C23H15FN4O3/c1-31-20-12-4-15(5-13-20)22-21(14-25)27(18-8-10-19(11-9-18)28(29)30)26-23(22)16-2-6-17(24)7-3-16/h2-13H,1H3
InChIKey ONDZLVMNWRBMCP-UHFFFAOYSA-N
Molecular Weight 414.396 g/mol
SMILES c1([n](nc(c1-c1ccc(cc1)OC)-c1ccc(cc1)F)-c1ccc(N(=O)=O)cc1)C#N
SPLASH splash10-03di-2000900000-f733280febfd09e82edc
Source of Spectrum D9-20-977-8c
Synonyms 5-(4-fluorophenyl)-4-(4-methoxyphenyl)-2-(4-nitrophenyl)-3-pyrazolecarbonitrile
Wiley ID 1695492