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trans-4,7,7-Trimethyl-2-oxabicyclo[4.1.1.]octan-3-one
SpectraBase Compound ID Bv0LySQ2s48
InChI InChI=1S/C10H16O2/c1-6-4-7-5-8(10(7,2)3)12-9(6)11/h6-8H,4-5H2,1-3H3/t6-,7+,8+/m0/s1
InChIKey OASBHXNKYZNOQC-XLPZGREQSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AfowwqK3eKN
Name trans-4,7,7-Trimethyl-2-oxabicyclo[4.1.1.]octan-3-one
Alternate Name(s) (1R,4S,6R)-4,7,7-Trimethyl-2-oxa-bicyclo[4.1.1]octan-3-one (1R,6R)-4,7,7-trimethyl-2-oxabicyclo[4.1.1]octan-3-one
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Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-6-4-7-5-8(10(7,2)3)12-9(6)11/h6-8H,4-5H2,1-3H3/t6-,7+,8+/m0/s1
InChIKey OASBHXNKYZNOQC-XLPZGREQSA-N
Molecular Weight 168.236 g/mol
SMILES [C@]12(OC([C@](C[C@@](C2(C)C)(C1)[H])(C)[H])=O)[H]
SPLASH splash10-014j-9000000000-2cc58eeecf5f3f6d2909
Source of Spectrum F-48-1938-18
Wiley ID 1165009