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(E)-3-acetoxy-4-bromo-but-2-enoic acid methyl ester
SpectraBase Compound ID 88cbUX129l4
InChI InChI=1S/C7H9BrO4/c1-5(9)12-6(4-8)3-7(10)11-2/h3H,4H2,1-2H3/b6-3+
InChIKey XWZOSTVSZQIUNK-ZZXKWVIFSA-N
Mol Weight 237.05 g/mol
Molecular Formula C7H9BrO4
Exact Mass 235.968422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGJcEKuplrJ
Name (E)-3-acetoxy-4-bromo-but-2-enoic acid methyl ester
Alternate Name(s) (E)-3-acetyloxy-4-bromo-2-butenoic acid methyl ester Methyl (E)-3-acetoxy-4-bromo-but-2-enoate Methyl (E)-3-acetyloxy-4-bromanyl-but-2-enoate Methyl (E)-3-acetyloxy-4-bromobut-2-enoate
CAS Registry Number 80367-81-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9BrO4
InChI InChI=1S/C7H9BrO4/c1-5(9)12-6(4-8)3-7(10)11-2/h3H,4H2,1-2H3/b6-3+
InChIKey XWZOSTVSZQIUNK-ZZXKWVIFSA-N
Molecular Weight 237.049 g/mol
SMILES CC(=O)O\C(CBr)=C/C(=O)OC
SPLASH splash10-0006-9600000000-ffa88c632c7ed5908041
Wiley ID 1481949