John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1qpsck1kfMJ SpectraBase Spectrum ID=1Iv8wLNCOYi

(accessed ).
QKOHEJBTNOEACF-UHFFFAOYSA-N
SpectraBase Compound ID 1qpsck1kfMJ
InChI InChI=1S/C6H8O2/c7-4-2-1-3-5-6(4)8-5/h5-6H,1-3H2
InChIKey QKOHEJBTNOEACF-UHFFFAOYSA-N
Mol Weight 112.13 g/mol
Molecular Formula C6H8O2
Exact Mass 112.05243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Iv8wLNCOYi
Name 7-OXABICYCLO[4.1.0]HEPTAN-2-ONE
Source of Sample N. Bensel, J. Hoehn, H. Marschall Chem. Ber. 112, 2256(1979)
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8O2
InChI InChI=1S/C6H8O2/c7-4-2-1-3-5-6(4)8-5/h5-6H,1-3H2
InChIKey QKOHEJBTNOEACF-UHFFFAOYSA-N
Molecular Weight 112.13
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian CFT-20
SpectraBase Batch ID CO5sAqoY4E6
Synonyms 7-OXABICYCLO/4.1.0/HEPTAN-2-ONE