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Ethyl 2-(5-oxo-1-(2-oxo-2H-chromene-3-carbonyl)-3-phenyl-4,5-dihydro-1H-pyrazol-4-yl)-2-(2-phenylhydrazono)acetate
SpectraBase Compound ID CCug126N3I2
InChI InChI=1S/C29H22N4O6/c1-2-38-29(37)25(31-30-20-14-7-4-8-15-20)23-24(18-11-5-3-6-12-18)32-33(27(23)35)26(34)21-17-19-13-9-10-16-22(19)39-28(21)36/h3-17,23,30H,2H2,1H3
InChIKey CEAQYRFPXMZAJB-UHFFFAOYSA-N
Mol Weight 522.52 g/mol
Molecular Formula C29H22N4O6
Exact Mass 522.153934 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F2NWMpU98yQ
Name Ethyl 2-(5-oxo-1-(2-oxo-2H-chromene-3-carbonyl)-3-phenyl-4,5-dihydro-1H-pyrazol-4-yl)-2-(2-phenylhydrazono)acetate
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H22N4O6
InChI InChI=1S/C29H22N4O6/c1-2-38-29(37)25(31-30-20-14-7-4-8-15-20)23-24(18-11-5-3-6-12-18)32-33(27(23)35)26(34)21-17-19-13-9-10-16-22(19)39-28(21)36/h3-17,23,30H,2H2,1H3
InChIKey CEAQYRFPXMZAJB-UHFFFAOYSA-N
Instrument Name Shimadzu GCMSQ1000-EX or HP 5988-A
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3235
Molecular Weight 522.517 g/mol
SMILES N(N=C(C(OCC)=O)C1C(=NN(C1=O)C(=O)C=1C(Oc2c(C1)cccc2)=O)c1ccccc1)c1ccccc1
SPLASH splash10-0729-9530610000-5fd1566b710dc0baca6e
Source of Spectrum Y-55-1963-4d
Wiley ID 1879256