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(E)-6-(4-Methoxyphenyl)-4-oxohex-5-enoic acid
SpectraBase Compound ID Fa4y1kIgvEG
InChI InChI=1S/C13H14O4/c1-17-12-7-3-10(4-8-12)2-5-11(14)6-9-13(15)16/h2-5,7-8H,6,9H2,1H3,(H,15,16)/b5-2+
InChIKey GYZWBYCGXJEGKK-GORDUTHDSA-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 IB1E4mRJ3dv
Name (E)-6-(4-Methoxyphenyl)-4-oxohex-5-enoic acid
Alternate Name(s) (E)-6-(4-methoxyphenyl)-4-oxo-5-hexenoic acid (E)-6-(4-methoxyphenyl)-4-oxo-hex-5-enoic acid (E)-6-(4-methoxyphenyl)-4-oxidanylidene-hex-5-enoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C13H14O4
InChI InChI=1S/C13H14O4/c1-17-12-7-3-10(4-8-12)2-5-11(14)6-9-13(15)16/h2-5,7-8H,6,9H2,1H3,(H,15,16)/b5-2+
InChIKey GYZWBYCGXJEGKK-GORDUTHDSA-N
Molecular Weight 234.251 g/mol
SMILES OC(CCC(\C=C\c1ccc(cc1)OC)=O)=O
SPLASH splash10-03di-9000000000-5d74861c832bbb4f97fc
Source of Spectrum G2-18-8474-2
Wiley ID 1662032