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2,5-Dimethyl-2,3,3a,4,5,6-hexahydrobenzofuran-7-carboxylic acid methyl ester
SpectraBase Compound ID Gy5VnDFetJZ
InChI InChI=1S/C12H18O3/c1-7-4-9-6-8(2)15-11(9)10(5-7)12(13)14-3/h7-9H,4-6H2,1-3H3
InChIKey GNKBKMYAPKMBMQ-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 4JV8c83IkSq
Name 2,5-Dimethyl-2,3,3a,4,5,6-hexahydrobenzofuran-7-carboxylic acid methyl ester
Alternate Name(s) Methyl 2,5-dimethyl-2,3,3a,4,5,6-hexahydro-1-benzofuran-7-carboxylate Methyl 2,5-dimethyl-2,3,3a,4,5,6-hexahydrobenzofuran-7-carboxylate
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Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-7-4-9-6-8(2)15-11(9)10(5-7)12(13)14-3/h7-9H,4-6H2,1-3H3
InChIKey GNKBKMYAPKMBMQ-UHFFFAOYSA-N
Molecular Weight 210.273 g/mol
SMILES C1(=C2C(CC(O2)C)CC(C1)C)C(=O)OC
SPLASH splash10-014r-0910000000-a47e8172eb9defaf65a0
Source of Spectrum F-70-10022-21
Wiley ID 1597900