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Methyl 4-bromobutanoate
SpectraBase Compound ID KNmSxWpF8Xl
InChI InChI=1S/C5H9BrO2/c1-8-5(7)3-2-4-6/h2-4H2,1H3
InChIKey QAWFLJGZSZIZHO-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 KWksPH6K5Xv
Name Butanoic acid, 4-bromo-, methyl ester
Alternate Name(s) Methyl 4-bromobutanoate 4-Bromobutanoic acid methyl ester 4-Bromobutyric acid methyl ester Butyric acid, 4-bromo-, methyl ester Methyl 4-bromanylbutanoate Methyl 4-bromobutyrate Methyl gamma-bromobutyrate EINECS 225-523-3
CAS Registry Number 4897-84-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H9BrO2
InChI InChI=1S/C5H9BrO2/c1-8-5(7)3-2-4-6/h2-4H2,1H3
InChIKey QAWFLJGZSZIZHO-UHFFFAOYSA-N
Molecular Weight 181.029 g/mol
SMILES C(CCCBr)(=O)OC
SPLASH splash10-0006-9200000000-3de498220fd45cc9c794
Source of Spectrum F-56-8087-0
Wiley ID 858944