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3-Furanpropanoic acid, 5-(hydroxymethyl)-, ethyl ester
SpectraBase Compound ID qrSxkW1Yjz
InChI InChI=1S/C10H14O4/c1-2-13-10(12)4-3-8-5-9(6-11)14-7-8/h5,7,11H,2-4,6H2,1H3
InChIKey KMIXRGHQWQNWJM-UHFFFAOYSA-N
Mol Weight 198.22 g/mol
Molecular Formula C10H14O4
Exact Mass 198.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6jls4sOVPA
Name 3-Furanpropanoic acid, 5-(hydroxymethyl)-, ethyl ester
CAS Registry Number 81793-16-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O4
InChI InChI=1S/C10H14O4/c1-2-13-10(12)4-3-8-5-9(6-11)14-7-8/h5,7,11H,2-4,6H2,1H3
InChIKey KMIXRGHQWQNWJM-UHFFFAOYSA-N
Molecular Weight 198.218 g/mol
SMILES OCc1cc(co1)CCC(=O)OCC
SPLASH splash10-0pdl-9400000000-44d7e8f436f4f03a8869
Source of Spectrum AC-1981-439-0
Synonyms 2-Hydroxymethyl-4-(2-ethoxycarbonyl-ethyl)-furan Ethyl 3-[5-(hydroxymethyl)-3-furyl]propanoate
Wiley ID 1195174