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6-(4-Isopropenyl-cyclohex-1-enylmethoxy)-cyclohexane-1,2,3,4,5-pentaol

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6-(4-Isopropenyl-cyclohex-1-enylmethoxy)-cyclohexane-1,2,3,4,5-pentaol
SpectraBase Compound ID 6MIn1KcnuGS
InChI InChI=1S/C16H26O6/c1-8(2)10-5-3-9(4-6-10)7-22-16-14(20)12(18)11(17)13(19)15(16)21/h3,10-21H,1,4-7H2,2H3/t10?,11-,12-,13-,14-,15-,16-/m0/s1
InChIKey FEMGBJYYPAKFKM-GRHOSVKNSA-N
Mol Weight 314.38 g/mol
Molecular Formula C16H26O6
Exact Mass 314.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A2TqewKyere
Name 6-(4-Isopropenyl-cyclohex-1-enylmethoxy)-cyclohexane-1,2,3,4,5-pentaol
Comments Computed using HOSE algorithm
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Exact Mass 314.172938551 u
Formula C16H26O6
InChI InChI=1S/C16H26O6/c1-8(2)10-5-3-9(4-6-10)7-22-16-14(20)12(18)11(17)13(19)15(16)21/h3,10-21H,1,4-7H2,2H3/t10?,11-,12-,13-,14-,15-,16-/m0/s1
InChIKey FEMGBJYYPAKFKM-GRHOSVKNSA-N
SMILES O[C@]1([C@]([C@]([C@@]([C@@]([C@@]1(OCC=1CCC(CC1)C(=C)C)[H])(O)[H])(O)[H])(O)[H])(O)[H])[H]