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2-Cyclohepten-1-one, 2,4-dimethyl-, (.+-.)-

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2-Cyclohepten-1-one, 2,4-dimethyl-, (.+-.)-
SpectraBase Compound ID D4NCgikn4Aj
InChI InChI=1S/C9H14O/c1-7-4-3-5-9(10)8(2)6-7/h6-7H,3-5H2,1-2H3
InChIKey UBMWZFRVBKIEEG-UHFFFAOYSA-N
Mol Weight 138.21 g/mol
Molecular Formula C9H14O
Exact Mass 138.104465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Yc2aWKWo6y
Name 2,4-DIMETHYL-2-CYCLOHEPTEN-1-ONE
Source of Sample C. H. Heathcock, C. M. Tice, T. C. Germroth J. Amer. Chem. Soc. 104, 6081(1982)
CAS Registry Number 83096-46-2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O
InChI InChI=1S/C9H14O/c1-7-4-3-5-9(10)8(2)6-7/h6-7H,3-5H2,1-2H3
InChIKey UBMWZFRVBKIEEG-UHFFFAOYSA-N
Molecular Weight 138.21
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Nicolet TT-23
Synonyms 2-CYCLOHEPTEN-1-ONE, 2,4-DIMETHYL-,