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1-Isobenzofuranacetic acid, 1,3-dihydro-7-(methoxycarbonyl)-3-oxo-, ethyl ester
SpectraBase Compound ID JtXGJ2CO2iO
InChI InChI=1S/C14H14O6/c1-3-19-11(15)7-10-12-8(13(16)18-2)5-4-6-9(12)14(17)20-10/h4-6,10H,3,7H2,1-2H3
InChIKey XBHQXYQCOUKIQI-UHFFFAOYSA-N
Mol Weight 278.26 g/mol
Molecular Formula C14H14O6
Exact Mass 278.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBCdG1j8scz
Name 1-Isobenzofuranacetic acid, 1,3-dihydro-7-(methoxycarbonyl)-3-oxo-, ethyl ester
CAS Registry Number 83465-43-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O6
InChI InChI=1S/C14H14O6/c1-3-19-11(15)7-10-12-8(13(16)18-2)5-4-6-9(12)14(17)20-10/h4-6,10H,3,7H2,1-2H3
InChIKey XBHQXYQCOUKIQI-UHFFFAOYSA-N
Molecular Weight 278.260 g/mol
SMILES C1(OC(CC(=O)OCC)c2c1cccc2C(=O)OC)=O
SPLASH splash10-0f6x-0970000000-a3cc51235d334369a8ae
Source of Spectrum KC-1982-1860-0
Synonyms 3-Ethoxy-carbonylmethyl-4-methoxycarbonylphthalide 3-Ethoxycarbonylmethyl-7-methoxycarbonylphthalide Methyl 3-(2-ethoxy-2-oxoethyl)-1-oxo-1,3-dihydro-2-benzofuran-4-carboxylate
Wiley ID 1281740