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(E,6Z)-6-[(4E,8E)-11-(3-furanyl)-4,8-dimethylundeca-4,8-dienylidene]-2-methyl-2-heptenedioic acid
SpectraBase Compound ID BVMfmb8FJM6
InChI InChI=1S/C25H34O5/c1-19(10-5-13-22-16-17-30-18-22)8-4-9-20(2)11-6-14-23(25(28)29)15-7-12-21(3)24(26)27/h9-10,12,14,16-18H,4-8,11,13,15H2,1-3H3,(H,26,27)(H,28,29)/b19-10+,20-9+,21-12+,23-14-
InChIKey PDLLQHLQXNHVGF-PPPKPQIRSA-N
Mol Weight 414.5 g/mol
Molecular Formula C25H34O5
Exact Mass 414.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ASirVAwWwEt
Name (E,6Z)-6-[(4E,8E)-11-(3-furanyl)-4,8-dimethylundeca-4,8-dienylidene]-2-methyl-2-heptenedioic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34O5
InChI InChI=1S/C25H34O5/c1-19(10-5-13-22-16-17-30-18-22)8-4-9-20(2)11-6-14-23(25(28)29)15-7-12-21(3)24(26)27/h9-10,12,14,16-18H,4-8,11,13,15H2,1-3H3,(H,26,27)(H,28,29)/b19-10+,20-9+,21-12+,23-14-
InChIKey PDLLQHLQXNHVGF-PPPKPQIRSA-N
Molecular Weight 414.542 g/mol
SMILES OC(\C(CC\C=C\(C(=O)O)C)=C\CC\C(=C\CC\C(=C\CCc1cocc1)C)C)=O
SPLASH splash10-001l-9220000000-949292d127f89a8d2c59
Source of Spectrum G4-60-796-3
Synonyms (E,6Z)-6-[(4E,8E)-11-(3-furyl)-4,8-dimethyl-undeca-4,8-dienylidene]-2-methyl-hept-2-enedioic acid (E,6Z)-6-[(4E,8E)-11-(furan-3-yl)-4,8-dimethyl-undeca-4,8-dienylidene]-2-methyl-hept-2-enedioic acid
Wiley ID 1606792