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Methyl 5,5-dimethyl-3-benzyl-4-oxohexanoate
SpectraBase Compound ID 1oKorJTyvoL
InChI InChI=1S/C16H22O3/c1-16(2,3)15(18)13(11-14(17)19-4)10-12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3
InChIKey GYYDOHBESOIODX-UHFFFAOYSA-N
Mol Weight 262.35 g/mol
Molecular Formula C16H22O3
Exact Mass 262.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5jCQkKyvbE
Name Methyl 5,5-dimethyl-3-benzyl-4-oxohexanoate
Alternate Name(s) methyl 3-benzyl-5,5-dimethyl-4-oxohexanoate
Comments Less than 3 mono-isotopic peaks
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Formula C16H22O3
InChI InChI=1S/C16H22O3/c1-16(2,3)15(18)13(11-14(17)19-4)10-12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3
InChIKey GYYDOHBESOIODX-UHFFFAOYSA-N
Molecular Weight 262.349 g/mol
SMILES C(C(C(C)(C)C)=O)(CC(=O)OC)Cc1ccccc1
SPLASH splash10-00di-0900000000-0b88f6cb5955e83bc6fa
Source of Spectrum H-80-513-4
Wiley ID 1266180