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2-Furanbutanoic acid, .beta.,.gamma.,.gamma.,5-tetramethyl-, methyl ester, (.+-.)-
SpectraBase Compound ID 5chhPsg3JLY
InChI InChI=1S/C13H20O3/c1-9(8-12(14)15-5)13(3,4)11-7-6-10(2)16-11/h6-7,9H,8H2,1-5H3
InChIKey BEHUPXOXRXFSQU-UHFFFAOYSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmkwYfnhjYW
Name 2-Furanbutanoic acid, .beta.,.gamma.,.gamma.,5-tetramethyl-, methyl ester, (.+-.)-
Alternate Name(s) Methyl 3,4-dimethyl-4-(5-methyl-2-furyl)pentanoate Methyl 3,4-dimethyl-4-(5-methylfuran-2-yl)pentanoate
CAS Registry Number 125280-50-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-9(8-12(14)15-5)13(3,4)11-7-6-10(2)16-11/h6-7,9H,8H2,1-5H3
InChIKey BEHUPXOXRXFSQU-UHFFFAOYSA-N
Molecular Weight 224.300 g/mol
SMILES c1(oc(C)cc1)C(C(CC(=O)OC)C)(C)C
SPLASH splash10-00di-1900000000-5a6e6eaa9050441a2ed2
Source of Spectrum H-72-762-22
Wiley ID 1225301