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5-Benzofuranacetic acid, 2,3-dihydro-2-(2-hydroxyethyl)-, methyl ester
SpectraBase Compound ID 8kWaxMpBsJX
InChI InChI=1S/C13H16O4/c1-16-13(15)7-9-2-3-12-10(6-9)8-11(17-12)4-5-14/h2-3,6,11,14H,4-5,7-8H2,1H3
InChIKey LRLQOMBPJAXHKJ-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EeSyD8lSSYO
Name 5-Benzofuranacetic acid, 2,3-dihydro-2-(2-hydroxyethyl)-, methyl ester
CAS Registry Number 76733-60-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-16-13(15)7-9-2-3-12-10(6-9)8-11(17-12)4-5-14/h2-3,6,11,14H,4-5,7-8H2,1H3
InChIKey LRLQOMBPJAXHKJ-UHFFFAOYSA-N
Molecular Weight 236.267 g/mol
SMILES OCCC1Oc2c(cc(cc2)CC(=O)OC)C1
SPLASH splash10-002b-2920000000-12333d48b23ac4b7ff93
Source of Spectrum KO-7-237-1
Synonyms Metabolite F of Furofenac Methyl[2-(2-hydroxyethyl)-2,3-dihydro-1-benzofuran-5-yl]acetate
Wiley ID 1238031