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3-(hydroxymethyl)-2,3-dihydrobenzofuran-5-carboxylic acid ethyl ester
SpectraBase Compound ID 8RZ09iC2JdB
InChI InChI=1S/C12H14O4/c1-2-15-12(14)8-3-4-11-10(5-8)9(6-13)7-16-11/h3-5,9,13H,2,6-7H2,1H3
InChIKey FWZKRMOBJPGJKK-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GvojE7H5hWj
Name 3-(hydroxymethyl)-2,3-dihydrobenzofuran-5-carboxylic acid ethyl ester
Alternate Name(s) 3-methylolcoumaran-5-carboxylic acid ethyl ester ethyl 3-(hydroxymethyl)-2,3-dihydro-1-benzofuran-5-carboxylate ethyl 3-(hydroxymethyl)-2,3-dihydrobenzofuran-5-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-2-15-12(14)8-3-4-11-10(5-8)9(6-13)7-16-11/h3-5,9,13H,2,6-7H2,1H3
InChIKey FWZKRMOBJPGJKK-UHFFFAOYSA-N
Molecular Weight 222.240 g/mol
SMILES OCC1c2cc(C(=O)OCC)ccc2OC1
SPLASH splash10-0006-0930000000-3e8a80894d3389fe08b2
Source of Spectrum J-58-2490-0
Wiley ID 1222310