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Ethyl 5-(4-Chlorobenzoyl)-2-(1H-pyrazol-1-yl)pyrimidine-4-carboxylate
SpectraBase Compound ID J6GcjQMtxYy
InChI InChI=1S/C17H13ClN4O3/c1-2-25-16(24)14-13(15(23)11-4-6-12(18)7-5-11)10-19-17(21-14)22-9-3-8-20-22/h3-10H,2H2,1H3
InChIKey GQXDXABLTSWHMO-UHFFFAOYSA-N
Mol Weight 356.77 g/mol
Molecular Formula C17H13ClN4O3
Exact Mass 356.067618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cr5SWXlzHRG
Name Ethyl 5-(4-Chlorobenzoyl)-2-(1H-pyrazol-1-yl)pyrimidine-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13ClN4O3
InChI InChI=1S/C17H13ClN4O3/c1-2-25-16(24)14-13(15(23)11-4-6-12(18)7-5-11)10-19-17(21-14)22-9-3-8-20-22/h3-10H,2H2,1H3
InChIKey GQXDXABLTSWHMO-UHFFFAOYSA-N
Molecular Weight 356.769 g/mol
SMILES c1(c(nc(nc1)-[n]1nccc1)C(=O)OCC)C(c1ccc(cc1)Cl)=O
SPLASH splash10-03e9-0694000000-8ea93dccc27ccd60e560
Source of Spectrum F4-40-3646-6e
Wiley ID 1671381