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3-((8Z,11E,13E)-8,11,13-Pendecatrienyl)catechol
SpectraBase Compound ID 5L7uqy6WKL7
InChI InChI=1S/C21H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(22)21(19)23/h2-5,7-8,15,17-18,22-23H,6,9-14,16H2,1H3/b3-2+,5-4+,8-7-
InChIKey IYROWZYPEIMDDN-YCLNNTPMSA-N
Mol Weight 314.47 g/mol
Molecular Formula C21H30O2
Exact Mass 314.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4noZhWO8gyM
Name 3-((8Z,11E,13E)-8,11,13-Pendecatrienyl)catechol
Alternate Name(s) 3-[(8Z,11E,13E)-8,11,13-pentadecatrienyl]-1,2-benzenediol
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Formula C21H30O2
InChI InChI=1S/C21H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(22)21(19)23/h2-5,7-8,15,17-18,22-23H,6,9-14,16H2,1H3/b3-2+,5-4+,8-7-
InChIKey IYROWZYPEIMDDN-YCLNNTPMSA-N
Molecular Weight 314.469 g/mol
SMILES Oc1c(c(ccc1)CCCCCCC\C=C/C\C=C\C=C\C)O
SPLASH splash10-03di-0900000000-26b8f255a3e9c1e0a853
Source of Spectrum AJ-64-2562-2
Wiley ID 1315610