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4-Bromo-3-methoxybutan-2-one
SpectraBase Compound ID D6kBNmOcMCk
InChI InChI=1S/C5H9BrO2/c1-4(7)5(3-6)8-2/h5H,3H2,1-2H3
InChIKey MMHABEMBDWOMNU-UHFFFAOYSA-N
Mol Weight 181.03 g/mol
Molecular Formula C5H9BrO2
Exact Mass 179.978593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HTJXavsATjb
Name 4-Bromo-3-methoxybutan-2-one
CAS Registry Number 113704-67-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H9BrO2
InChI InChI=1S/C5H9BrO2/c1-4(7)5(3-6)8-2/h5H,3H2,1-2H3
InChIKey MMHABEMBDWOMNU-UHFFFAOYSA-N
Molecular Weight 181.029 g/mol
SMILES C(C(OC)CBr)(=O)C
SPLASH splash10-052f-9100000000-d0de0722506a53261d68
Source of Spectrum J-53-2202-0
Synonyms 4-Bromanyl-3-methoxy-butan-2-one 4-Bromo-3-methoxy-2-butanone
Wiley ID 1175586