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7-Acetoxy-3-ethoxycarbonylethyl-4-methyl-coumarin
SpectraBase Compound ID JVajox6BOyt
InChI InChI=1S/C17H18O6/c1-4-21-16(19)8-7-14-10(2)13-6-5-12(22-11(3)18)9-15(13)23-17(14)20/h5-6,9H,4,7-8H2,1-3H3
InChIKey JKHIKEKJSCZBOY-UHFFFAOYSA-N
Mol Weight 318.33 g/mol
Molecular Formula C17H18O6
Exact Mass 318.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J5J9cEjLu9W
Name 3-(7-acetoxy-2-keto-4-methyl-chromen-3-yl)propionic acid ethyl ester
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Formula C17H18O6
InChI InChI=1S/C17H18O6/c1-4-21-16(19)8-7-14-10(2)13-6-5-12(22-11(3)18)9-15(13)23-17(14)20/h5-6,9H,4,7-8H2,1-3H3
InChIKey JKHIKEKJSCZBOY-UHFFFAOYSA-N
Molecular Weight 318.325 g/mol
SMILES C=1(C(Oc2c(C1C)ccc(OC(=O)C)c2)=O)CCC(=O)OCC
SPLASH splash10-0udi-0190000000-b312e17441d83819e455
Source of Spectrum A7-0-0-27
Synonyms 3-(7-acetyloxy-4-methyl-2-oxo-1-benzopyran-3-yl)propanoic acid ethyl ester Ethyl 3-(7-acetoxy-4-methyl-2-oxo-chromen-3-yl)propanoate Ethyl 3-(7-acetyloxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoate Ethyl 3-(7-acetyloxy-4-methyl-2-oxochromen-3-yl)propanoate
Wiley ID 1318392