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Methyl 2-Butyl-4,5-dimethylfuran-3-carboxylate
SpectraBase Compound ID CHSefI3ymb2
InChI InChI=1S/C12H18O3/c1-5-6-7-10-11(12(13)14-4)8(2)9(3)15-10/h5-7H2,1-4H3
InChIKey HAOGLURMWSNFGI-UHFFFAOYSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rKAUIXvMcj
Name Methyl 2-Butyl-4,5-dimethylfuran-3-carboxylate
Alternate Name(s) 2-Butyl-4,5-dimethyl-3-furancarboxylic acid methyl ester Methyl 2-butyl-4,5-dimethyl-furan-3-carboxylate
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Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-5-6-7-10-11(12(13)14-4)8(2)9(3)15-10/h5-7H2,1-4H3
InChIKey HAOGLURMWSNFGI-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo301628n
Molecular Weight 210.273 g/mol
SMILES c1(c(c(c(o1)CCCC)C(OC)=O)C)C
SPLASH splash10-0gbi-1910000000-2a2e892f2259226de1d5
Source of Spectrum J-77-8664-2e
Wiley ID 1747065