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(2,4-hexadienyl)(4-oxocyclopentene-1-yl)-dimethylmalonate
SpectraBase Compound ID FovjhaoWMD1
InChI InChI=1S/C16H20O5/c1-4-5-6-7-10-20-14(18)16(2,3)15(19)21-13-9-8-12(17)11-13/h4-7,9H,8,10-11H2,1-3H3/b5-4+,7-6+
InChIKey FFQNILQDYMNTLB-YTXTXJHMSA-N
Mol Weight 292.33 g/mol
Molecular Formula C16H20O5
Exact Mass 292.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EPlKtFCQ2k7
Name (2,4-hexadienyl)(4-oxocyclopentene-1-yl)-dimethylmalonate
CAS Registry Number 110027-66-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O5
InChI InChI=1S/C16H20O5/c1-4-5-6-7-10-20-14(18)16(2,3)15(19)21-13-9-8-12(17)11-13/h4-7,9H,8,10-11H2,1-3H3/b5-4+,7-6+
InChIKey FFQNILQDYMNTLB-YTXTXJHMSA-N
Molecular Weight 292.331 g/mol
SMILES C(C(OC1=CCC(C1)=O)=O)(C(=O)OC\C=C\C=C\C)(C)C
SPLASH splash10-001i-9840000000-2212e56a958a2d7c0842
Source of Spectrum K-120-2011-7
Synonyms (3,5-hexadienyl)(4-oxo-2-cyclopentene1-yl)-dimethylmalonate 1-[(2E,4E)-2,4-hexadienyl]3-(4-oxo-1-cyclopenten-1-yl) 2,2-dimethylmalonate
Wiley ID 1295395