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(E)-Methyl 3-(4-oxo-4H-1-benzopyran-3-yl)propenoate
SpectraBase Compound ID J0RVwKZJeKE
InChI InChI=1S/C13H10O4/c1-16-12(14)7-6-9-8-17-11-5-3-2-4-10(11)13(9)15/h2-8H,1H3/b7-6+
InChIKey XUWOEDIFNCTUHW-VOTSOKGWSA-N
Mol Weight 230.22 g/mol
Molecular Formula C13H10O4
Exact Mass 230.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BXtnC7VD7tK
Name (E)-Methyl 3-(4-oxo-4H-1-benzopyran-3-yl)propenoate
Comments Less than 3 mono-isotopic peaks
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Formula C13H10O4
InChI InChI=1S/C13H10O4/c1-16-12(14)7-6-9-8-17-11-5-3-2-4-10(11)13(9)15/h2-8H,1H3/b7-6+
InChIKey XUWOEDIFNCTUHW-VOTSOKGWSA-N
Molecular Weight 230.219 g/mol
SMILES C1(C(=COc2c1cccc2)\C=C\C(=O)OC)=O
SPLASH splash10-00di-0900000000-f3dc9bdb8354509f1937
Source of Spectrum F-50-11776-73
Synonyms methyl (2E)-3-(4-oxo-4H-chromen-3-yl)-2-propenoate
Wiley ID 789701