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1-(5-chloro-2-thienyl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)-2-propen-1-one
SpectraBase Compound ID D4pwfa17INw
InChI InChI=1S/C12H11ClN2OS/c1-8-9(7-14-15(8)2)3-4-10(16)11-5-6-12(13)17-11/h3-7H,1-2H3/b4-3+
InChIKey ODMZSKOTYRCWSM-ONEGZZNKSA-N
Mol Weight 266.75 g/mol
Molecular Formula C12H11ClN2OS
Exact Mass 266.028062 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JG7wIKbroGK
Name 1-(5-Chloro-2-thienyl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)-2-propen-1-one
Alternate Name(s) (E)-1-(5-chloranylthiophen-2-yl)-3-(1,5-dimethylpyrazol-4-yl)prop-2-en-1-one (E)-1-(5-chloro-2-thienyl)-3-(1,5-dimethylpyrazol-4-yl)prop-2-en-1-one (E)-1-(5-chloro-2-thiophenyl)-3-(1,5-dimethyl-4-pyrazolyl)-2-propen-1-one (E)-1-(5-chlorothiophen-2-yl)-3-(1,5-dimethylpyrazol-4-yl)prop-2-en-1-one Propenone, 1-(5-chlorothiophen-2-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)-
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Formula C12H11ClN2OS
InChI InChI=1S/C12H11ClN2OS/c1-8-9(7-14-15(8)2)3-4-10(16)11-5-6-12(13)17-11/h3-7H,1-2H3/b4-3+
InChIKey ODMZSKOTYRCWSM-ONEGZZNKSA-N
Molecular Weight 266.746 g/mol
SMILES c1(sc(cc1)Cl)C(\C=C\c1c([n](C)nc1)C)=O
SPLASH splash10-014j-3690000000-fee31cc5f484e28ce16e
Wiley ID 1446298