John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=HEJ2ALd59N5 SpectraBase Spectrum ID=1JMzSK3JjHk

(accessed ).
trans-3,4-DIMETHYLCYCLOPENTANONE
SpectraBase Compound ID HEJ2ALd59N5
InChI InChI=1S/C7H12O/c1-5-3-7(8)4-6(5)2/h5-6H,3-4H2,1-2H3
InChIKey ZMGMYCHEWPVBEL-UHFFFAOYSA-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

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1JMzSK3JjHk
Name trans-3,4-DIMETHYLCYCLOPENTANONE
Source of Sample J. B. Stothers, C. T. Tan Can. J. Chem. 52, 308(1974)
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-5-3-7(8)4-6(5)2/h5-6H,3-4H2,1-2H3
InChIKey ZMGMYCHEWPVBEL-UHFFFAOYSA-N
Molecular Weight 112.17
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian XL-100
SpectraBase Batch ID KDJflqFhGjC