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3-(1-hydroxyethyl)-2,3-dihydrobenzofuran-5-carboxylic acid ethyl ester
SpectraBase Compound ID 2coN6lO8JWf
InChI InChI=1S/C13H16O4/c1-3-16-13(15)9-4-5-12-10(6-9)11(7-17-12)8(2)14/h4-6,8,11,14H,3,7H2,1-2H3
InChIKey HDNLXMVGBFPJPI-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 AHrXvgYEuRD
Name 3-(1-hydroxyethyl)-2,3-dihydrobenzofuran-5-carboxylic acid ethyl ester
Alternate Name(s) 3-(1-hydroxyethyl)coumaran-5-carboxylic acid ethyl ester ethyl 3-(1-hydroxyethyl)-2,3-dihydro-1-benzofuran-5-carboxylate ethyl 3-(1-hydroxyethyl)-2,3-dihydrobenzofuran-5-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-3-16-13(15)9-4-5-12-10(6-9)11(7-17-12)8(2)14/h4-6,8,11,14H,3,7H2,1-2H3
InChIKey HDNLXMVGBFPJPI-UHFFFAOYSA-N
Molecular Weight 236.267 g/mol
SMILES OC(C1c2cc(C(=O)OCC)ccc2OC1)C
SPLASH splash10-0006-9020000000-a6c79008d71b7245dc23
Source of Spectrum J-58-2490-0
Wiley ID 1238133