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(1R/S,4R/S)-3-KETOCINEOLE

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(1R/S,4R/S)-3-KETOCINEOLE
SpectraBase Compound ID I6tyAfI6yyt
InChI InChI=1S/C10H16O2/c1-9(2)7-4-5-10(3,12-9)6-8(7)11/h7H,4-6H2,1-3H3/t7-,10+/m1/s1
InChIKey RFXTXEOQEMTRHL-XCBNKYQSSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LSADlNcIQYm
Name 1,3,3-TRIMETHYL-2-OXABICYCLO-[2.2.2]-OCTAN-5-ONE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-9(2)7-4-5-10(3,12-9)6-8(7)11/h7H,4-6H2,1-3H3/t7-,10+/m1/s1
InChIKey RFXTXEOQEMTRHL-XCBNKYQSSA-N
Literature Reference Author R.M.CARMAN,M.T.FLETCHER
Literature Reference Citation AUSTR.J.CHEM.,39,1723(1986)
Literature Reference DOI 10.1071/ch9861723
Molecular Weight 168.236 g/mol
Solvent Unknown
Source File Reference UWRH1066