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Ethyl 3-cinnamoyl-1,5-diphenyl-1H-pyrazole-4-carboxylate
SpectraBase Compound ID 9WIEOf6qelE
InChI InChI=1S/C27H22N2O3/c1-2-32-27(31)24-25(23(30)19-18-20-12-6-3-7-13-20)28-29(22-16-10-5-11-17-22)26(24)21-14-8-4-9-15-21/h3-19H,2H2,1H3
InChIKey TXRWMBLWJVXGED-UHFFFAOYSA-N
Mol Weight 422.48 g/mol
Molecular Formula C27H22N2O3
Exact Mass 422.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfWctpdqNx3
Name Ethyl 3-cinnamoyl-1,5-diphenyl-1H-pyrazole-4-carboxylate
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H22N2O3
InChI InChI=1S/C27H22N2O3/c1-2-32-27(31)24-25(23(30)19-18-20-12-6-3-7-13-20)28-29(22-16-10-5-11-17-22)26(24)21-14-8-4-9-15-21/h3-19H,2H2,1H3
InChIKey TXRWMBLWJVXGED-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-Q1000-EX Or HP 5988-A
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3257
Molecular Weight 422.484 g/mol
SMILES C(C)OC(=O)c1c(n[n](c1-c1ccccc1)-c1ccccc1)C(C=Cc1ccccc1)=O
SPLASH splash10-004i-9200000000-fe28cf867e2e45bea6c5
Source of Spectrum Y-55-2126-5g
Wiley ID 1879278