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Ethyl 5-cyano-3-(4'-fluorophenyl)-1,4-bis(p-nitrophenyl)-2-pyrazoline-5-carboxylate
SpectraBase Compound ID KEv52fIWE5m
InChI InChI=1S/C25H18FN5O6/c1-2-37-24(32)25(15-27)22(16-5-9-20(10-6-16)30(33)34)23(17-3-7-18(26)8-4-17)28-29(25)19-11-13-21(14-12-19)31(35)36/h3-14,22H,2H2,1H3
InChIKey VGCKISNKEVNTAY-UHFFFAOYSA-N
Mol Weight 503.45 g/mol
Molecular Formula C25H18FN5O6
Exact Mass 503.124111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3sYcpkhtdA
Name Ethyl 5-cyano-3-(4'-fluorophenyl)-1,4-bis(p-nitrophenyl)-2-pyrazoline-5-carboxylate
Alternate Name(s) 3-cyano-5-(4-fluorophenyl)-2,4-bis(4-nitrophenyl)-4H-pyrazole-3-carboxylic acid ethyl ester Ethyl 3-cyano-5-(4-fluorophenyl)-2,4-bis(4-nitrophenyl)-4H-pyrazole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H18FN5O6
InChI InChI=1S/C25H18FN5O6/c1-2-37-24(32)25(15-27)22(16-5-9-20(10-6-16)30(33)34)23(17-3-7-18(26)8-4-17)28-29(25)19-11-13-21(14-12-19)31(35)36/h3-14,22H,2H2,1H3
InChIKey VGCKISNKEVNTAY-UHFFFAOYSA-N
Molecular Weight 503.446 g/mol
SMILES C1(N(N=C(C1c1ccc(N(=O)=O)cc1)c1ccc(F)cc1)c1ccc(N(=O)=O)cc1)(C(=O)OCC)C#N
SPLASH splash10-003r-2001910000-776002c6a7108d3a39f7
Source of Spectrum D9-20-980-15f
Wiley ID 1695473