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(6aR,10aR)-3-(1-Hexyl-cyclopent-1-yl)-6,6a,7,8,10,10a-hexahydro-1-hydroxy-6,6-dimethyl-9H-dibenzo[b,d]pyran-9-one
SpectraBase Compound ID 14IWknokOSo
InChI InChI=1S/C26H38O3/c1-4-5-6-7-12-26(13-8-9-14-26)18-15-22(28)24-20-17-19(27)10-11-21(20)25(2,3)29-23(24)16-18/h15-16,20-21,28H,4-14,17H2,1-3H3/t20-,21-/m1/s1
InChIKey OGEWEAZPOMIFJZ-NHCUHLMSSA-N
Mol Weight 398.6 g/mol
Molecular Formula C26H38O3
Exact Mass 398.282095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A8Ma5iyqfo4
Name (6aR,10aR)-3-(1-Hexyl-cyclopent-1-yl)-6,6a,7,8,10,10a-hexahydro-1-hydroxy-6,6-dimethyl-9H-dibenzo[b,d]pyran-9-one
Appearance White foam
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Formula C26H38O3
InChI InChI=1S/C26H38O3/c1-4-5-6-7-12-26(13-8-9-14-26)18-15-22(28)24-20-17-19(27)10-11-21(20)25(2,3)29-23(24)16-18/h15-16,20-21,28H,4-14,17H2,1-3H3/t20-,21-/m1/s1
InChIKey OGEWEAZPOMIFJZ-NHCUHLMSSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jm100641g
Molecular Weight 398.587 g/mol
SMILES Oc1c2[C@@]3(CC(CC[C@]3(C(Oc2cc(c1)C1(CCCCCC)CCCC1)(C)C)[H])=O)[H]
SPLASH splash10-03dj-1019000000-71c9dcf694bddbe93bc2
Source of Spectrum AF-53-7003-6b
Wiley ID 1846301