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Methyl (4S)-6-Bromo-4-methylhexanoate
SpectraBase Compound ID 3iff50YiMEy
InChI InChI=1S/C8H15BrO2/c1-7(5-6-9)3-4-8(10)11-2/h7H,3-6H2,1-2H3/t7-/m0/s1
InChIKey INPIXQOEAFBKGN-ZETCQYMHSA-N
Mol Weight 223.11 g/mol
Molecular Formula C8H15BrO2
Exact Mass 222.025543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3qClkvraPqP
Name Methyl (4S)-6-Bromo-4-methylhexanoate
Comments Less than 3 mono-isotopic peaks
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Formula C8H15BrO2
InChI InChI=1S/C8H15BrO2/c1-7(5-6-9)3-4-8(10)11-2/h7H,3-6H2,1-2H3/t7-/m0/s1
InChIKey INPIXQOEAFBKGN-ZETCQYMHSA-N
Molecular Weight 223.110 g/mol
SMILES C(=O)(CC[C@@](CCBr)(C)[H])OC
SPLASH splash10-00i0-0090000000-04cb958eddc4c93ae778
Source of Spectrum U1-2011-5899-3
Wiley ID 1688658