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(2E)-1-(5-bromo-2-thienyl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)-2-propen-1-one
SpectraBase Compound ID EBewFRhYruU
InChI InChI=1S/C12H11BrN2OS/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 KVUZWXAXPLRFPO-ONEGZZNKSA-N
Mol Weight 311.2 g/mol
Molecular Formula C12H11BrN2OS
Exact Mass 309.977547 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B33hXFeNGCm
Name (E)-1-(5-bromanylthiophen-2-yl)-3-(1,5-dimethylpyrazol-4-yl)prop-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11BrN2OS
InChI InChI=1S/C12H11BrN2OS/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 KVUZWXAXPLRFPO-ONEGZZNKSA-N
Molecular Weight 311.197 g/mol
SMILES C(\C=C\c1cn[n](c1C)C)(c1ccc(s1)Br)=O
SPLASH splash10-06sj-9621000000-7c0037e3d5a6f96e9c34
Synonyms (E)-1-(5-bromo-2-thienyl)-3-(1,5-dimethylpyrazol-4-yl)prop-2-en-1-one (E)-1-(5-bromo-2-thiophenyl)-3-(1,5-dimethyl-4-pyrazolyl)-2-propen-1-one (E)-1-(5-bromothiophen-2-yl)-3-(1,5-dimethylpyrazol-4-yl)prop-2-en-1-one
Wiley ID 1511893