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Butanedioic acid, [2-(tetrahydro-2-methyl-2-furanyl)ethyl]-, 4-ethyl ester
SpectraBase Compound ID CB1STlOmElC
InChI InChI=1S/C13H22O5/c1-3-17-11(14)9-10(12(15)16)5-7-13(2)6-4-8-18-13/h10H,3-9H2,1-2H3,(H,15,16)
InChIKey KMSRERHUMSSENE-UHFFFAOYSA-N
Mol Weight 258.31 g/mol
Molecular Formula C13H22O5
Exact Mass 258.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6t9KTQTPIHA
Name Butanedioic acid, [2-(tetrahydro-2-methyl-2-furanyl)ethyl]-, 4-ethyl ester
Alternate Name(s) 4-Ethoxy-2-[2-(2-methyltetrahydro-2-furanyl)ethyl]-4-oxobutanoic acid 4-Ethyl 1-hydrogen 2-[2-(tetrahydro-2-methyl-2-furanyl)ethyl]butanedioate
CAS Registry Number 94483-82-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O5
InChI InChI=1S/C13H22O5/c1-3-17-11(14)9-10(12(15)16)5-7-13(2)6-4-8-18-13/h10H,3-9H2,1-2H3,(H,15,16)
InChIKey KMSRERHUMSSENE-UHFFFAOYSA-N
Molecular Weight 258.314 g/mol
SMILES OC(C(CC(=O)OCC)CCC1(OCCC1)C)=O
SPLASH splash10-000i-9000000000-c1ac8ed37c0231d0d820
Source of Spectrum J-50-215-0
Wiley ID 1261562