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3-Furanhexanoic acid, .epsilon.-hydroxy-.beta.-methyl-, ethyl ester
SpectraBase Compound ID 5PuET5YW6kg
InChI InChI=1S/C13H20O4/c1-3-17-13(15)8-10(2)4-5-12(14)11-6-7-16-9-11/h6-7,9-10,12,14H,3-5,8H2,1-2H3
InChIKey SPFSOCVBTZUTKL-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ElNNMnxWk63
Name 3-Furanhexanoic acid, .epsilon.-hydroxy-.beta.-methyl-, ethyl ester
CAS Registry Number 128671-57-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-3-17-13(15)8-10(2)4-5-12(14)11-6-7-16-9-11/h6-7,9-10,12,14H,3-5,8H2,1-2H3
InChIKey SPFSOCVBTZUTKL-UHFFFAOYSA-N
Molecular Weight 240.299 g/mol
SMILES OC(c1cocc1)CCC(CC(=O)OCC)C
SPLASH splash10-00kb-6900000000-71338d0ddcfbaefcb280
Source of Spectrum F-46-1206-11
Synonyms Ethyl (6-(e'-furyl)-6-hydroxy-3-methyl)hexanoate Ethyl 6-(3-furyl)-6-hydroxy-3-methylhexanoate
Wiley ID 1242859