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3-((8Z,11E,13E)-8,11,13-Pendecatrienyl)catechol Diacetate
SpectraBase Compound ID 5C2eH9K3o0G
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/h4-7,9-10,17,19-20H,8,11-16,18H2,1-3H3/b5-4+,7-6+,10-9+
InChIKey SVYBWALKHVPVGM-ZYXMWXIMSA-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 8bdp9GnDk6y
Name 3-((8Z,11E,13E)-8,11,13-Pendecatrienyl)catechol Diacetate
Alternate Name(s) 2-(acetyloxy)-3-[(8E,11E,13E)-8,11,13-pentadecatrienyl]phenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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/h4-7,9-10,17,19-20H,8,11-16,18H2,1-3H3/b5-4+,7-6+,10-9+
InChIKey SVYBWALKHVPVGM-ZYXMWXIMSA-N
Molecular Weight 398.543 g/mol
SMILES c1(c(OC(=O)C)cccc1CCCCCCC\C=C\C\C=C\C=C\C)OC(=O)C
SPLASH splash10-00di-0906000000-8d70720e837c476e4d7f
Source of Spectrum AJ-64-2562-11
Wiley ID 1368608