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(E)-3-[4-[(E)-3-butoxy-3-keto-prop-1-enyl]-3,3,6,6-tetramethoxy-cyclohexa-1,4-dien-1-yl]acrylic acid butyl ester
SpectraBase Compound ID JnzCj6CNw7s
InChI InChI=1S/C24H36O8/c1-7-9-15-31-21(25)13-11-19-17-24(29-5,30-6)20(18-23(19,27-3)28-4)12-14-22(26)32-16-10-8-2/h11-14,17-18H,7-10,15-16H2,1-6H3/b13-11+,14-12+
InChIKey JZFIKYTVUVNTMO-PHEQNACWSA-N
Mol Weight 452.5 g/mol
Molecular Formula C24H36O8
Exact Mass 452.241018 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2zHu9H8yae
Name (E)-3-[4-[(E)-3-butoxy-3-keto-prop-1-enyl]-3,3,6,6-tetramethoxy-cyclohexa-1,4-dien-1-yl]acrylic acid butyl ester
Alternate Name(s) (E)-3-[4-[(E)-3-butoxy-3-oxoprop-1-enyl]-3,3,6,6-tetramethoxy-1-cyclohexa-1,4-dienyl]-2-propenoic acid butyl ester Butyl (E)-3-[4-[(E)-3-butoxy-3-oxidanylidene-prop-1-enyl]-3,3,6,6-tetramethoxy-cyclohexa-1,4-dien-1-yl]prop-2-enoate Butyl (E)-3-[4-[(E)-3-butoxy-3-oxo-prop-1-enyl]-3,3,6,6-tetramethoxy-cyclohexa-1,4-dien-1-yl]prop-2-enoate
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Formula C24H36O8
InChI InChI=1S/C24H36O8/c1-7-9-15-31-21(25)13-11-19-17-24(29-5,30-6)20(18-23(19,27-3)28-4)12-14-22(26)32-16-10-8-2/h11-14,17-18H,7-10,15-16H2,1-6H3/b13-11+,14-12+
InChIKey JZFIKYTVUVNTMO-PHEQNACWSA-N
Molecular Weight 452.544 g/mol
SMILES C1(C(=CC(C(=C1)\C=C\C(=O)OCCCC)(OC)OC)\C=C\C(=O)OCCCC)(OC)OC
SPLASH splash10-0a6r-9500000000-d2609681c1efe8e738f4
Source of Spectrum U1-1998-601-7
Wiley ID 751029