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4-[[6-(Ethoxycarbonyl)-trans-5-hexenyl]oxy]-6-methyl-2-pyrone
SpectraBase Compound ID AzzgnLxwt2
InChI InChI=1S/C15H20O5/c1-3-18-14(16)8-6-4-5-7-9-19-13-10-12(2)20-15(17)11-13/h6,8,10-11H,3-5,7,9H2,1-2H3/b8-6+
InChIKey DRHKEPSQZSATMZ-SOFGYWHQSA-N
Mol Weight 280.32 g/mol
Molecular Formula C15H20O5
Exact Mass 280.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ET6P2gbkdRA
Name 4-[[6-(Ethoxycarbonyl)-trans-5-hexenyl]oxy]-6-methyl-2-pyrone
CAS Registry Number 136721-18-1
Comments Less than 3 mono-isotopic peaks
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Formula C15H20O5
InChI InChI=1S/C15H20O5/c1-3-18-14(16)8-6-4-5-7-9-19-13-10-12(2)20-15(17)11-13/h6,8,10-11H,3-5,7,9H2,1-2H3/b8-6+
InChIKey DRHKEPSQZSATMZ-SOFGYWHQSA-N
Molecular Weight 280.320 g/mol
SMILES C=1C(OC(=CC1OCCCC\C=C\C(=O)OCC)C)=O
SPLASH splash10-001i-9050000000-ed25ee798b0531dc360f
Source of Spectrum J-56-7153-6
Synonyms ethyl (2E)-7-[(6-methyl-2-oxo-2H-pyran-4-yl)oxy]-2-heptenoate
Wiley ID 1283832