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1-(3,5-dimethyl-1-thiophen-2-ylcarbonyl-pyrazol-4-yl)ethanone
SpectraBase Compound ID BKySf8P4sUi
InChI InChI=1S/C12H12N2O2S/c1-7-11(9(3)15)8(2)14(13-7)12(16)10-5-4-6-17-10/h4-6H,1-3H3
InChIKey XLSZSMPHMZYMTA-UHFFFAOYSA-N
Mol Weight 248.3 g/mol
Molecular Formula C12H12N2O2S
Exact Mass 248.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID W7BrUPZmRN
Name 1-(3,5-dimethyl-1-thiophen-2-ylcarbonyl-pyrazol-4-yl)ethanone
Alternate Name(s) 1-[3,5-dimethyl-1-(2-thenoyl)pyrazol-4-yl]ethanone 1-[3,5-dimethyl-1-(thiophene-2-carbonyl)pyrazol-4-yl]ethanone 1-[3,5-dimethyl-1-[oxo(thiophen-2-yl)methyl]-4-pyrazolyl]ethanone Ethanone, 1-[3,5-dimethyl-1-(thiophene-2-carbonyl)-1H-pyrazol-4-yl]-
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Formula C12H12N2O2S
InChI InChI=1S/C12H12N2O2S/c1-7-11(9(3)15)8(2)14(13-7)12(16)10-5-4-6-17-10/h4-6H,1-3H3
InChIKey XLSZSMPHMZYMTA-UHFFFAOYSA-N
Molecular Weight 248.300 g/mol
SMILES CC(c1c([n](nc1C)C(c1sccc1)=O)C)=O
SPLASH splash10-03di-7920000000-d2c213879b3ec1c049a6
Wiley ID 1438982