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2-Benzyl-6-bromo-3-oxohexanoic Acid Methyl Ester
SpectraBase Compound ID 4USQsHAdpKX
InChI InChI=1S/C14H17BrO3/c1-18-14(17)12(13(16)8-5-9-15)10-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3
InChIKey WVOQDBFGASSRRH-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 25cVWrGU9Vt
Name 2-Benzyl-6-bromo-3-oxohexanoic Acid Methyl Ester
Alternate Name(s) Methyl 2-benzyl-6-bromo-3-oxohexanoate
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Formula C14H17BrO3
InChI InChI=1S/C14H17BrO3/c1-18-14(17)12(13(16)8-5-9-15)10-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3
InChIKey WVOQDBFGASSRRH-UHFFFAOYSA-N
Molecular Weight 313.191 g/mol
SMILES C(C(C(CCCBr)=O)Cc1ccccc1)(=O)OC
SPLASH splash10-0w30-1950000000-51b5ba5128e1413e8d14
Source of Spectrum F-70-3822-3
Wiley ID 1596836