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(E)-6-[3-[(E)-6-ethoxy-6-keto-hex-4-enoxy]-2-keto-1-pyridyl]hex-2-enoic acid ethyl ester
SpectraBase Compound ID 5Cw8n3g4oWB
InChI InChI=1S/C21H29NO6/c1-3-26-19(23)13-7-5-9-15-22-16-11-12-18(21(22)25)28-17-10-6-8-14-20(24)27-4-2/h7-8,11-14,16H,3-6,9-10,15,17H2,1-2H3/b13-7+,14-8+
InChIKey QDNMBTDMXVVOCA-FNCQTZNRSA-N
Mol Weight 391.46 g/mol
Molecular Formula C21H29NO6
Exact Mass 391.199488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KeoZeeV63XJ
Name (E)-6-[3-[(E)-6-ethoxy-6-keto-hex-4-enoxy]-2-keto-1-pyridyl]hex-2-enoic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C21H29NO6
InChI InChI=1S/C21H29NO6/c1-3-26-19(23)13-7-5-9-15-22-16-11-12-18(21(22)25)28-17-10-6-8-14-20(24)27-4-2/h7-8,11-14,16H,3-6,9-10,15,17H2,1-2H3/b13-7+,14-8+
InChIKey QDNMBTDMXVVOCA-FNCQTZNRSA-N
Molecular Weight 391.464 g/mol
SMILES C1(N(C=CC=C1OCCC\C=C\C(=O)OCC)CCC\C=C\C(=O)OCC)=O
SPLASH splash10-03di-0902000000-66c9062d0b66c648377c
Source of Spectrum J-57-5711-6
Synonyms (E)-6-[3-[(E)-6-ethoxy-6-oxohex-4-enoxy]-2-oxo-1-pyridinyl]-2-hexenoic acid ethyl ester ethyl (E)-6-[3-[(E)-6-ethoxy-6-oxidanylidene-hex-4-enoxy]-2-oxidanylidene-pyridin-1-yl]hex-2-enoate ethyl (E)-6-[3-[(E)-6-ethoxy-6-oxo-hex-4-enoxy]-2-oxo-1-pyridyl]hex-2-enoate ethyl (E)-6-[3-[(E)-6-ethoxy-6-oxohex-4-enoxy]-2-oxopyridin-1-yl]hex-2-enoate
Wiley ID 1365356