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9.alpha.-tert-Butyl-1.beta.,2.alpha.,6.alpha.,9.beta.-tetrahydro-7.beta.-methyl-8,10-dioxa-11-oxotricyclo[6.4.0.0(2,6)]undecane
SpectraBase Compound ID AVcGqp4Db9r
InChI InChI=1S/C14H22O3/c1-13(2,3)12-16-11(15)10-8-6-5-7-9(8)14(10,4)17-12/h8-10,12H,5-7H2,1-4H3/t8-,9+,10-,12+,14-/m1/s1
InChIKey LXFYBCIDNBBDHO-MVKNRQEXSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID dvZlWT7MO
Name 9.alpha.-tert-Butyl-1.beta.,2.alpha.,6.alpha.,9.beta.-tetrahydro-7.beta.-methyl-8,10-dioxa-11-oxotricyclo[6.4.0.0(2,6)]undecane
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Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-13(2,3)12-16-11(15)10-8-6-5-7-9(8)14(10,4)17-12/h8-10,12H,5-7H2,1-4H3/t8-,9+,10-,12+,14-/m1/s1
InChIKey LXFYBCIDNBBDHO-MVKNRQEXSA-N
Molecular Weight 238.327 g/mol
SMILES [C@@]12([C@](C(=O)O[C@@](O2)(C(C)(C)C)[H])([H])[C@]2([C@@]1(CCC2)[H])[H])C
SPLASH splash10-0fki-4900000000-5e64156530f9226624b0
Source of Spectrum C-116-3321-13
Synonyms (2R,4aS,4bR,7aS,7bR)-2-tert-butyl-7b-methylhexahydrocyclopenta[3,4]cyclobuta[1,2-d][1,3]dioxin-4(4aH)-one
Wiley ID 1240882