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Acetic acid, (5-methoxy-3(2H)-benzofuranylidene)-, ethyl ester, (E)-
SpectraBase Compound ID JhpCISSCmx0
InChI InChI=1S/C13H14O4/c1-3-16-13(14)6-9-8-17-12-5-4-10(15-2)7-11(9)12/h4-7H,3,8H2,1-2H3/b9-6-
InChIKey ZPYNCPKTPKNLHD-TWGQIWQCSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LckYoGJcrEb
Name Acetic acid, (5-methoxy-3(2H)-benzofuranylidene)-, ethyl ester, (E)-
Alternate Name(s) ethyl (2E)-(5-methoxy-1-benzofuran-3(2H)-ylidene)ethanoate Ethyl 5'-methoxy-3'-benzofurylideneacetate
CAS Registry Number 56798-49-3
Comments Less than 3 mono-isotopic peaks
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Formula C13H14O4
InChI InChI=1S/C13H14O4/c1-3-16-13(14)6-9-8-17-12-5-4-10(15-2)7-11(9)12/h4-7H,3,8H2,1-2H3/b9-6-
InChIKey ZPYNCPKTPKNLHD-TWGQIWQCSA-N
Molecular Weight 234.251 g/mol
SMILES c12\C(COc2ccc(c1)OC)=C/C(=O)OCC
SPLASH splash10-03e9-0970000000-42596153e38a1e68f3e1
Source of Spectrum B-28-1105-0
Wiley ID 1235868