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2-Furanpropanoic acid, .alpha.-acetyl-2,5-dihydro-4-methyl-5-oxo-, methyl ester
SpectraBase Compound ID CPfwwjuoikp
InChI InChI=1S/C11H14O5/c1-6-4-8(16-10(6)13)5-9(7(2)12)11(14)15-3/h4,8-9H,5H2,1-3H3
InChIKey JMAVHGYAHTUTTB-UHFFFAOYSA-N
Mol Weight 226.23 g/mol
Molecular Formula C11H14O5
Exact Mass 226.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IYt9oGKChuh
Name 2-Furanpropanoic acid, .alpha.-acetyl-2,5-dihydro-4-methyl-5-oxo-, methyl ester
CAS Registry Number 80741-99-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O5
InChI InChI=1S/C11H14O5/c1-6-4-8(16-10(6)13)5-9(7(2)12)11(14)15-3/h4,8-9H,5H2,1-3H3
InChIKey JMAVHGYAHTUTTB-UHFFFAOYSA-N
Molecular Weight 226.228 g/mol
SMILES C1(C(=CC(O1)CC(C(=O)OC)C(=O)C)C)=O
SPLASH splash10-000g-9400000000-9ce8b57e4fee8a6a09c6
Source of Spectrum H-64-2276-0
Synonyms Methyl 2-[(4-methyl-5-oxo-2,5-dihydro-2-furanyl)methyl]-3-oxobutanoate Methylester of 2-[(3-methyl-2-oxo-5H-furan-5-yl)methyl]-3-oxo-butryric acid
Wiley ID 1227029