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Methyl 5-Methyl-3-bromo-4-oxo-2-hexenoate
SpectraBase Compound ID BueiQWh1xWt
InChI InChI=1S/C8H11BrO3/c1-5(2)8(11)6(9)4-7(10)12-3/h4-5H,1-3H3/b6-4-
InChIKey SLGWBLHAIJPFCP-XQRVVYSFSA-N
Mol Weight 235.08 g/mol
Molecular Formula C8H11BrO3
Exact Mass 233.989157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ISf31C8FnTO
Name Methyl 5-Methyl-3-bromo-4-oxo-2-hexenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11BrO3
InChI InChI=1S/C8H11BrO3/c1-5(2)8(11)6(9)4-7(10)12-3/h4-5H,1-3H3/b6-4-
InChIKey SLGWBLHAIJPFCP-XQRVVYSFSA-N
Molecular Weight 235.077 g/mol
SMILES C(\C(=C\C(=O)OC)Br)(=O)C(C)C
SPLASH splash10-0006-9540000000-38c72ad001cb5ee84a37
Source of Spectrum J-60-1819-15
Synonyms Methyl (2Z)-3-bromo-5-methyl-4-oxo-2-hexenoate
Wiley ID 1235333