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3-bromobutyric acid, ethyl ester
SpectraBase Compound ID 9F0RoUCdSZv
InChI InChI=1S/C6H11BrO2/c1-3-9-6(8)4-5(2)7/h5H,3-4H2,1-2H3
InChIKey OPXQLUFLTHEZST-UHFFFAOYSA-N
Mol Weight 195.06 g/mol
Molecular Formula C6H11BrO2
Exact Mass 193.994243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FefCZCLlk99
Name Butanoic acid, 3-bromo-, ethyl ester
Alternate Name(s) .beta.-Bromobutyric acid ethyl ester 3-Bromobutanoic acid ethyl ester 3-Bromobutyric acid ethyl ester Butyric acid, 3-bromo-, ethyl ester Ethyl 3-bromanylbutanoate Ethyl 3-bromobutanoate Ethyl 3-bromobutyrate EINECS 231-059-2 NSC 8856
CAS Registry Number 7425-49-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11BrO2
InChI InChI=1S/C6H11BrO2/c1-3-9-6(8)4-5(2)7/h5H,3-4H2,1-2H3
InChIKey OPXQLUFLTHEZST-UHFFFAOYSA-N
Molecular Weight 195.056 g/mol
SMILES CC(CC(=O)OCC)Br
SPLASH splash10-006x-9400000000-9a8e2b5227bccad1a093
Source of Spectrum W6-15067-0-0
Wiley ID 90830