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Methyl 8-bromo-3-oxooctanoate

View entire compound with spectra: 1 MS (GC)

Methyl 8-bromo-3-oxooctanoate
SpectraBase Compound ID 3QSWMYjVReO
InChI InChI=1S/C9H15BrO3/c1-13-9(12)7-8(11)5-3-2-4-6-10/h2-7H2,1H3
InChIKey WNTSQJDLZIUPIY-UHFFFAOYSA-N
Mol Weight 251.12 g/mol
Molecular Formula C9H15BrO3
Exact Mass 250.020457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QJAbQMMeAu
Name Methyl 8-bromo-3-oxooctanoate
Alternate Name(s) 8-Bromo-3-oxooctanoic acid methyl ester Methyl 8-bromo-3-oxo-octanoate Methyl 8-bromanyl-3-oxidanylidene-octanoate
CAS Registry Number 64670-06-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15BrO3
InChI InChI=1S/C9H15BrO3/c1-13-9(12)7-8(11)5-3-2-4-6-10/h2-7H2,1H3
InChIKey WNTSQJDLZIUPIY-UHFFFAOYSA-N
Molecular Weight 251.120 g/mol
SMILES C(C(=O)OC)C(=O)CCCCCBr
SPLASH splash10-0006-9200000000-a9a88c0f2d9e2373c8c2
Source of Spectrum I-55-998-0
Wiley ID 1252627