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2-Methyl-3-bromo-3-butenoic acid
SpectraBase Compound ID A7lIP6fdywe
InChI InChI=1S/C5H7BrO2/c1-3(4(2)6)5(7)8/h3H,2H2,1H3,(H,7,8)
InChIKey LEUFVHGPJJGMOQ-UHFFFAOYSA-N
Mol Weight 179.01 g/mol
Molecular Formula C5H7BrO2
Exact Mass 177.962942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EeSyrQ1rGSD
Name 2-Methyl-3-bromo-3-butenoic acid
Alternate Name(s) 3-bromo-2-methyl-3-butenoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C5H7BrO2
InChI InChI=1S/C5H7BrO2/c1-3(4(2)6)5(7)8/h3H,2H2,1H3,(H,7,8)
InChIKey LEUFVHGPJJGMOQ-UHFFFAOYSA-N
Molecular Weight 179.013 g/mol
SMILES OC(C(C(=C)Br)C)=O
SPLASH splash10-0udi-9300000000-11039bd7c89dbab37b6e
Source of Spectrum SO-0-721-2
Wiley ID 863742