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5-Benzofuranacetic acid, 2-ethyl-, methyl ester
SpectraBase Compound ID KaXYbEsxiio
InChI InChI=1S/C13H14O3/c1-3-11-8-10-6-9(7-13(14)15-2)4-5-12(10)16-11/h4-6,8H,3,7H2,1-2H3
InChIKey DBAODOWNDWXYMH-UHFFFAOYSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Gtb87YMlc3
Name 5-Benzofuranacetic acid, 2-ethyl-, methyl ester
CAS Registry Number 76733-58-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-3-11-8-10-6-9(7-13(14)15-2)4-5-12(10)16-11/h4-6,8H,3,7H2,1-2H3
InChIKey DBAODOWNDWXYMH-UHFFFAOYSA-N
Molecular Weight 218.252 g/mol
SMILES c1(oc2c(c1)cc(cc2)CC(=O)OC)CC
SPLASH splash10-0aor-1940000000-bac81f8bebfb6d8f34d8
Source of Spectrum KO-7-237-1
Synonyms Metabolite J of Furofenac Methyl (2-ethyl-1-benzofuran-5-yl)acetate
Wiley ID 1217688