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3-Methyl-5-hexyl-2(5H)-furanone
SpectraBase Compound ID JmQSAsOrMpS
InChI InChI=1S/C11H18O2/c1-3-4-5-6-7-10-8-9(2)11(12)13-10/h8,10H,3-7H2,1-2H3
InChIKey YEAMKPCNIMSIFB-UHFFFAOYSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AELJA9Iq5yh
Name 3-Methyl-5-hexyl-2(5H)-furanone
Alternate Name(s) 5-hexyl-3-methyl-2(5H)-furanone
Comments Less than 3 mono-isotopic peaks
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Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-3-4-5-6-7-10-8-9(2)11(12)13-10/h8,10H,3-7H2,1-2H3
InChIKey YEAMKPCNIMSIFB-UHFFFAOYSA-N
Molecular Weight 182.263 g/mol
SMILES C1(OC(C=C1C)CCCCCC)=O
SPLASH splash10-0006-9000000000-1052ee604663823a14ce
Source of Spectrum KC-57-1587-2
Wiley ID 1622944