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1(E),3(E),7(E),11(E)-CEMBrATETRAENE-14,15-DIOL

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1(E),3(E),7(E),11(E)-CEMBrATETRAENE-14,15-DIOL
SpectraBase Compound ID JtMmQkCHwcu
InChI InChI=1S/C20H32O2/c1-15-8-6-10-16(2)12-13-18(20(4,5)22)19(21)14-17(3)11-7-9-15/h8,11-13,19,21-22H,6-7,9-10,14H2,1-5H3/b15-8+,16-12+,17-11+,18-13+
InChIKey SAZDJCIBQKXMSM-QIRUVYGCSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HLkocKQ4OGm
Name 1,3,7,11-Cembratetraene-14,15-diol
Alternate Name(s) (2E,4E,8E,12E)-2-(2-hydroxypropan-2-yl)-5,9,13-trimethyl-1-cyclotetradeca-2,4,8,12-tetraenol (2E,4E,8E,12E)-2-(2-hydroxypropan-2-yl)-5,9,13-trimethylcyclotetradeca-2,4,8,12-tetraen-1-ol (2E,4E,8E,12E)-5,9,13-trimethyl-2-(2-oxidanylpropan-2-yl)cyclotetradeca-2,4,8,12-tetraen-1-ol
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Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-15-8-6-10-16(2)12-13-18(20(4,5)22)19(21)14-17(3)11-7-9-15/h8,11-13,19,21-22H,6-7,9-10,14H2,1-5H3/b15-8+,16-12+,17-11+,18-13+
InChIKey SAZDJCIBQKXMSM-QIRUVYGCSA-N
Molecular Weight 304.474 g/mol
SMILES OC1C\C(=C\CC\C(=C\CC\C(=C\C=C\1C(O)(C)C)C)C)C
SPLASH splash10-0006-9710000000-2a6450380c27d68e7341
Source of Spectrum G4-59-597-3
Wiley ID 1606329