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6-Bromo-3-oxo-2-p-tolylhexanoic Acid Methyl Ester
SpectraBase Compound ID 7sgYKXuFrDh
InChI InChI=1S/C14H17BrO3/c1-10-5-7-11(8-6-10)13(14(17)18-2)12(16)4-3-9-15/h5-8,13H,3-4,9H2,1-2H3
InChIKey VMYYXPFUFQSFDK-UHFFFAOYSA-N
Mol Weight 313.19 g/mol
Molecular Formula C14H17BrO3
Exact Mass 312.036107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FHhD1VfIN0w
Name 6-Bromo-3-oxo-2-p-tolylhexanoic Acid Methyl Ester
Alternate Name(s) Methyl 6-bromo-2-(4-methylphenyl)-3-oxohexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17BrO3
InChI InChI=1S/C14H17BrO3/c1-10-5-7-11(8-6-10)13(14(17)18-2)12(16)4-3-9-15/h5-8,13H,3-4,9H2,1-2H3
InChIKey VMYYXPFUFQSFDK-UHFFFAOYSA-N
Molecular Weight 313.191 g/mol
SMILES C(C(C(CCCBr)=O)c1ccc(cc1)C)(=O)OC
SPLASH splash10-03e9-0900000000-4df8d16ceebc205a9c0c
Source of Spectrum F-70-3822-3
Wiley ID 1596834