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3-((8Z,11Z)-8,11,14-Pendecatrienyl)catechol Diacetate
SpectraBase Compound ID DVlXLRrFswf
InChI InChI=1S/C25H34O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-23-19-17-20-24(28-21(2)26)25(23)29-22(3)27/h4,6-7,9-10,17,19-20H,1,5,8,11-16,18H2,2-3H3/b7-6-,10-9-
InChIKey ZJXJDLAGYOHKDA-HZJYTTRNSA-N
Mol Weight 398.5 g/mol
Molecular Formula C25H34O4
Exact Mass 398.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Q6KltvIeIF
Name 3-((8Z,11Z)-8,11,14-Pendecatrienyl)catechol Diacetate
Alternate Name(s) 2-(acetyloxy)-3-[(8Z,11Z)-8,11,14-pentadecatrienyl]phenyl acetate
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Formula C25H34O4
InChI InChI=1S/C25H34O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-23-19-17-20-24(28-21(2)26)25(23)29-22(3)27/h4,6-7,9-10,17,19-20H,1,5,8,11-16,18H2,2-3H3/b7-6-,10-9-
InChIKey ZJXJDLAGYOHKDA-HZJYTTRNSA-N
Molecular Weight 398.543 g/mol
SMILES c1(c(OC(=O)C)cccc1CCCCCCC\C=C/C\C=C/CC=C)OC(=O)C
SPLASH splash10-00di-0901000000-1bdb105b7c008398769c
Source of Spectrum AJ-64-2561-10
Wiley ID 1368607