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1,3,3-Trimethyl-2-oxabicyclo[2.2.2]octan-6-ol (D1)
SpectraBase Compound ID 2WuTIXjafXa
InChI InChI=1S/C10H18O2/c1-9(2)7-4-5-10(3,12-9)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8?,10+/m1/s1
InChIKey YVCUGZBVCHODNB-SHTILUHOSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lPPnOZLzUy
Name 1,3,3-Trimethyl-2-oxabicyclo[2.2.2]octan-6-ol (D1)
Alternate Name(s) 2-Oxabicyclo[2.2.2]octan-6-ol, 1,3,3-trimethyl- (D1) p-Menthan-2-ol, 1,8-epoxy- (D1) 2,2,4-Trimethyl-3-oxabicyclo[2.2.2]octan-5-ol (D1) exo-2-Hydroxycineole (D1)
CAS Registry Number 79413-79-9
Comments Note: The molecular formula of the structure shown is C10H18O2 - which differs from the formula reported for the mass spectrum (C10H17DO2)
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Formula C10H17DO2
InChI InChI=1S/C10H18O2/c1-9(2)7-4-5-10(3,12-9)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8?,10+/m1/s1
InChIKey YVCUGZBVCHODNB-SHTILUHOSA-N
Molecular Weight 170.252 g/mol
SMILES OC1C[C@]2(CC[C@@]1(OC2(C)C)C)[H]
SPLASH splash10-052f-9300000000-9eb6717183e006a2d1b3
Wiley ID 1487289