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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 3fcc4Jpn3HC
Name (1R/S,4R/S)-3-KETOCINEOLE
Compound Number 4
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,W.T.ROBINSON,C.J.WALLIS
Literature Reference Citation AUSTR.J.CHEM.,58,785(2005)
Literature Reference DOI 10.1071/CH05144
Molecular Weight 168.236 g/mol
Sample ID 28993
Solvent CDCl3