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Ethyl 1-benzoyl-4-cyano-5-oxo-2,5-dihydro-1H-pyrazole-3-carboxylate
SpectraBase Compound ID IFYzBohZcNG
InChI InChI=1S/C14H11N3O4/c1-2-21-14(20)11-10(8-15)13(19)17(16-11)12(18)9-6-4-3-5-7-9/h3-7,16H,2H2,1H3
InChIKey DQKBAGVSKIOHIG-UHFFFAOYSA-N
Mol Weight 285.26 g/mol
Molecular Formula C14H11N3O4
Exact Mass 285.074956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2K0LD3N53Q
Name Ethyl 1-benzoyl-4-cyano-5-oxo-2,5-dihydro-1H-pyrazole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11N3O4
InChI InChI=1S/C14H11N3O4/c1-2-21-14(20)11-10(8-15)13(19)17(16-11)12(18)9-6-4-3-5-7-9/h3-7,16H,2H2,1H3
InChIKey DQKBAGVSKIOHIG-UHFFFAOYSA-N
Molecular Weight 285.259 g/mol
SMILES N1N(C(C(=C1C(=O)OCC)C#N)=O)C(=O)c1ccccc1
SPLASH splash10-0arr-9760000000-11bac4d77bbb290389f3
Source of Spectrum F2-44-3486-11a
Synonyms 2-Benzoyl-4-cyano-3-oxo-1H-pyrazole-5-carboxylic acid ethyl ester Ethyl 2-benzoyl-4-cyano-3-oxo-1H-pyrazole-5-carboxylate Ethyl 4-cyano-3-oxidanylidene-2-(phenylcarbonyl)-1H-pyrazole-5-carboxylate
Wiley ID 1705964