John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=2LruvLgN3zl SpectraBase Spectrum ID=10z0mfmKNoS

(accessed ).
NRFMZKXHPJBQBW-DSYKOEDSSA-N
SpectraBase Compound ID 2LruvLgN3zl
InChI InChI=1S/C7H12O/c1-5-3-2-4-6-7(5)8-6/h5-7H,2-4H2,1H3/t5-,6+,7-/m1/s1
InChIKey NRFMZKXHPJBQBW-DSYKOEDSSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10z0mfmKNoS
Name NRFMZKXHPJBQBW-DSYKOEDSSA-N
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-5-3-2-4-6-7(5)8-6/h5-7H,2-4H2,1H3/t5-,6+,7-/m1/s1
InChIKey NRFMZKXHPJBQBW-DSYKOEDSSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 112.172 g/mol
Source File Reference MHKO2763
SpectraBase Batch ID LCp1CJ04OLK