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Ethyl-5-(4-chlorophenyl) 3-oxo-2,3-dihydro-1H-pyrazol-4-carboxylate
SpectraBase Compound ID J5mnSjfDbZn
InChI InChI=1S/C12H11ClN2O3/c1-2-18-12(17)9-10(14-15-11(9)16)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H2,14,15,16)
InChIKey YCQNSGOVPFCDDL-UHFFFAOYSA-N
Mol Weight 266.68 g/mol
Molecular Formula C12H11ClN2O3
Exact Mass 266.04582 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8kpjkM8Ssdu
Name Ethyl-5-(4-chlorophenyl) 3-oxo-2,3-dihydro-1H-pyrazol-4-carboxylate
Alternate Name(s) 3-(4-chlorophenyl)-5-oxo-1,2-dihydropyrazole-4-carboxylic acid ethyl ester ethyl 3-(4-chlorophenyl)-5-oxo-1,2-dihydropyrazole-4-carboxylate ethyl 3-(4-chlorophenyl)-5-oxidanylidene-1,2-dihydropyrazole-4-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11ClN2O3
InChI InChI=1S/C12H11ClN2O3/c1-2-18-12(17)9-10(14-15-11(9)16)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H2,14,15,16)
InChIKey YCQNSGOVPFCDDL-UHFFFAOYSA-N
Molecular Weight 266.684 g/mol
SMILES N1NC(C(=C1c1ccc(cc1)Cl)C(=O)OCC)=O
SPLASH splash10-014i-0090000000-83410744340476ba5708
Source of Spectrum F2-44-4630-3i
Wiley ID 1705852