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Isocubenol
SpectraBase Compound ID 60hus92NDud
InChI InChI=1S/C15H26O/c1-10(2)13-6-5-12(4)15(16)8-7-11(3)9-14(13)15/h9-13,16H,5-8H2,1-4H3/t11-,12-,13+,15-/m1/s1
InChIKey PHWPOXHXHWFTMY-GUIRCDHDSA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 84u2CmC7hmo
Name Isocubenol
Alternate Name(s) (1S,4R,4aR,7R)-1-isopropyl-4,7-dimethyl-1,3,4,5,6,7-hexahydro-4a(2H)-naphthalenol (1S,4R,4aR,7R)-4,7-dimethyl-1-propan-2-yl-2,3,4,5,6,7-hexahydro-1H-naphthalen-4a-ol
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Formula C15H26O
InChI InChI=1S/C15H26O/c1-10(2)13-6-5-12(4)15(16)8-7-11(3)9-14(13)15/h9-13,16H,5-8H2,1-4H3/t11-,12-,13+,15-/m1/s1
InChIKey PHWPOXHXHWFTMY-GUIRCDHDSA-N
Molecular Weight 222.372 g/mol
SMILES O[C@]12C([C@@](CC[C@]2(C)[H])(C(C)C)[H])=C[C@@](CC1)(C)[H]
SPLASH splash10-004i-0900000000-f6c292a2775deddb0b54
Source of Spectrum F-50-4753-18
Wiley ID 1223562