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2-Furanbutanoic acid, .gamma.,.gamma.,5-trimethyl-, methyl ester
SpectraBase Compound ID 9vV2Q5yZ91F
InChI InChI=1S/C12H18O3/c1-9-5-6-10(15-9)12(2,3)8-7-11(13)14-4/h5-6H,7-8H2,1-4H3
InChIKey GGXYNZXTVUXBRZ-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 78qf6jnktQS
Name 2-Furanbutanoic acid, .gamma.,.gamma.,5-trimethyl-, methyl ester
Alternate Name(s) Methyl 4-methyl-4-(5-methyl-2-furyl)pentanoate Methyl 4-methyl-4-(5-methylfuran-2-yl)pentanoate
CAS Registry Number 125254-48-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-9-5-6-10(15-9)12(2,3)8-7-11(13)14-4/h5-6H,7-8H2,1-4H3
InChIKey GGXYNZXTVUXBRZ-UHFFFAOYSA-N
Molecular Weight 210.273 g/mol
SMILES c1(oc(C)cc1)C(CCC(=O)OC)(C)C
SPLASH splash10-00di-1900000000-dd3cf37c34868fcf70f3
Source of Spectrum H-72-762-19
Wiley ID 1209233