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(E)-6-(3,4-Dimethoxyphenyl)-4-oxohex-5-enoic acid
SpectraBase Compound ID 6h3n92IX0vo
InChI InChI=1S/C14H16O5/c1-18-12-7-4-10(9-13(12)19-2)3-5-11(15)6-8-14(16)17/h3-5,7,9H,6,8H2,1-2H3,(H,16,17)/b5-3+
InChIKey LWVLDMUWGLSASG-HWKANZROSA-N
Mol Weight 264.28 g/mol
Molecular Formula C14H16O5
Exact Mass 264.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LIBfS3QxXQb
Name (E)-6-(3,4-Dimethoxyphenyl)-4-oxohex-5-enoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C14H16O5
InChI InChI=1S/C14H16O5/c1-18-12-7-4-10(9-13(12)19-2)3-5-11(15)6-8-14(16)17/h3-5,7,9H,6,8H2,1-2H3,(H,16,17)/b5-3+
InChIKey LWVLDMUWGLSASG-HWKANZROSA-N
Molecular Weight 264.277 g/mol
SMILES OC(CCC(\C=C\c1cc(c(cc1)OC)OC)=O)=O
SPLASH splash10-03di-9000000000-5d74861c832bbb4f97fc
Source of Spectrum G2-18-8474-1
Synonyms (E)-6-(3,4-dimethoxyphenyl)-4-oxo-5-hexenoic acid (E)-6-(3,4-dimethoxyphenyl)-4-oxo-hex-5-enoic acid (E)-6-(3,4-dimethoxyphenyl)-4-oxidanylidene-hex-5-enoic acid
Wiley ID 1662033