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(2E)-1-(5-bromo-2-thienyl)-3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-propen-1-one
SpectraBase Compound ID LvwJcdMZOAI
InChI InChI=1S/C12H11BrN2OS/c1-8-9(7-15(2)14-8)3-4-10(16)11-5-6-12(13)17-11/h3-7H,1-2H3/b4-3+
InChIKey SAWXWMJXJZTVSY-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 9SI3nkaNjhL
Name (E)-1-(5-bromanylthiophen-2-yl)-3-(1,3-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(7-15(2)14-8)3-4-10(16)11-5-6-12(13)17-11/h3-7H,1-2H3/b4-3+
InChIKey SAWXWMJXJZTVSY-ONEGZZNKSA-N
Molecular Weight 311.197 g/mol
SMILES C(\C=C\c1c(n[n](c1)C)C)(c1ccc(s1)Br)=O
SPLASH splash10-0f7w-9720000000-d6931da50ee596aee475
Synonyms (E)-1-(5-bromo-2-thienyl)-3-(1,3-dimethylpyrazol-4-yl)prop-2-en-1-one (E)-1-(5-bromo-2-thiophenyl)-3-(1,3-dimethyl-4-pyrazolyl)-2-propen-1-one (E)-1-(5-bromothiophen-2-yl)-3-(1,3-dimethylpyrazol-4-yl)prop-2-en-1-one Propenone, 1-(5-bromothiophen-2-yl)-3-(1,3-dimethyl-1H-pyrazol-4-yl)-
Wiley ID 1441159