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ClEOSPINOL-A
SpectraBase Compound ID CoqppsW83EW
InChI InChI=1S/C20H32O2/c1-14(2)18-10-9-15(3)7-6-8-16(4)11-19(21)12-17(5)20(22)13-18/h8-9,12,18-22H,1,6-7,10-11,13H2,2-5H3/b15-9+,16-8+,17-12+/t18-,19+,20-/m0/s1
InChIKey GNHCOOWDEKAJLG-XELOQSTNSA-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 LWL6rYJZwBv
Name 10R,13S-dihydroxy-4,8,12-trimethyl-1-(1-methylethenyl)-3(E),7(E),11(E)-cyclotetradecatriene
Appearance oil
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Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-14(2)18-10-9-15(3)7-6-8-16(4)11-19(21)12-17(5)20(22)13-18/h8-9,12,18-22H,1,6-7,10-11,13H2,2-5H3/b15-9+,16-8+,17-12+/t18-,19+,20-/m0/s1
InChIKey GNHCOOWDEKAJLG-XELOQSTNSA-N
Instrument Name VG 70-250S
Ionization Type EI
Literature Reference DOI 10.1021/np0303299
Molecular Weight 304.474 g/mol
Optical Rotation [a]D25 = +79.2 (c = 15.0, CHCl3)
Reported Formula C20H32O2
SMILES O[C@@]1(C\C(=C\CC\C(=C\C[C@@](C[C@@](\C(=C\1)C)(O)[H])(C(C)=C)[H])C)C)[H]
SPLASH splash10-0l7j-9201000000-7370b3f087d35dd558ef
Source of Spectrum G4-67-182-1
Synonyms Cleospinol A
Wiley ID 1881647