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1,9-Dimethyl-3.beta.-hydroperoxy-7.alpha.-methoxy-2,8,12-trioxatetracyclo[7.2.1.0(.4,11)0.(6,10)]dodecane
SpectraBase Compound ID 4v74t3E0Vbm
InChI InChI=1S/C12H18O6/c1-11-7-5(9(14-3)15-11)4-6-8(7)12(2,18-11)16-10(6)17-13/h5-10,13H,4H2,1-3H3/t5?,6?,7?,8?,9-,10+,11?,12?/m1/s1
InChIKey UAIVWHWXZWCCEH-MZMLEMSXSA-N
Mol Weight 258.27 g/mol
Molecular Formula C12H18O6
Exact Mass 258.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G31wudPEWwg
Name 1,9-Dimethyl-3.beta.-hydroperoxy-7.alpha.-methoxy-2,8,12-trioxatetracyclo[7.2.1.0(.4,11)0.(6,10)]dodecane
Comments Less than 3 mono-isotopic peaks
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Formula C12H18O6
InChI InChI=1S/C12H18O6/c1-11-7-5(9(14-3)15-11)4-6-8(7)12(2,18-11)16-10(6)17-13/h5-10,13H,4H2,1-3H3/t5?,6?,7?,8?,9-,10+,11?,12?/m1/s1
InChIKey UAIVWHWXZWCCEH-MZMLEMSXSA-N
Molecular Weight 258.270 g/mol
SMILES OO[C@@]1(OC2(C3C4C(CC13)[C@@](OC4(O2)C)(OC)[H])C)[H]
SPLASH splash10-0udi-0900000000-04f37fbed57c8ca19140
Source of Spectrum F-67-7240-6a
Wiley ID 1687682