John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=Hmn2zK9nqOj SpectraBase Spectrum ID=2viBJi4IOzU

(accessed ).
(E,2R,6R)-2-TERT.-BUTYL-6-METHYL-5-ETHYLIDEN-1,3-DIOXAN-4-ONE
SpectraBase Compound ID Hmn2zK9nqOj
InChI InChI=1S/C11H18O3/c1-6-8-7(2)13-10(11(3,4)5)14-9(8)12/h6-7,10H,1-5H3/b8-6+/t7-,10-/m1/s1
InChIKey APDRCOWRJUJNIJ-QMCCYZMISA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125595 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2viBJi4IOzU
Name (E,2R,6R)-2-TERT.-BUTYL-6-METHYL-5-ETHYLIDEN-1,3-DIOXAN-4-ONE
CAS Registry Number 129287-44-1
Compound Number E-10
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-6-8-7(2)13-10(11(3,4)5)14-9(8)12/h6-7,10H,1-5H3/b8-6+/t7-,10-/m1/s1
InChIKey APDRCOWRJUJNIJ-QMCCYZMISA-N
Literature Reference Author W.AMBERG,D.SEEBACH
Literature Reference Citation CHEM.BER.,123,2413(1990)
Literature Reference DOI 10.1002/cber.19901231225
Molecular Weight 198.262 g/mol
Solvent CDCl3
Source File Reference UWED12713
SpectraBase Batch ID DnDRjoERGJe