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3,3-DIMETHYLBICYCLO-[2.2.2]-OCTAN-2-ON
SpectraBase Compound ID CC5rJsPZ7KU
InChI InChI=1S/C10H16O/c1-10(2)8-5-3-7(4-6-8)9(10)11/h7-8H,3-6H2,1-2H3/t7-,8+
InChIKey WQCZOWCFNNRSMD-OCAPTIKFSA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ElfdY2iUe7Z
Name 3,3-Dimethylbicyclo[2.2.2]octan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O
InChI InChI=1S/C10H16O/c1-10(2)8-5-3-7(4-6-8)9(10)11/h7-8H,3-6H2,1-2H3/t7-,8+
InChIKey WQCZOWCFNNRSMD-OCAPTIKFSA-N
Literature Reference DOI 10.1002/cber.19821151105
Molecular Weight 152.237 g/mol
SMILES C1[C@]2(CC[C@@](C1)(C(C2=O)(C)C)[H])[H]
SPLASH splash10-001i-9300000000-cc52560a1c2dd5b81644
Source of Spectrum K-115-3524-10
Synonyms (1s,4s)-3,3-dimethylbicyclo[2.2.2]octan-2-one
Wiley ID 1791909