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4-Tert-butylcyclohexanone

View entire compound with spectra: 92 NMR, 6 FTIR, and 21 MS (GC)

4-Tert-butylcyclohexanone
SpectraBase Compound ID 3eFmrI8bObt
InChI InChI=1S/C10H18O/c1-10(2,3)8-4-6-9(11)7-5-8/h8H,4-7H2,1-3H3
InChIKey YKFKEYKJGVSEIX-UHFFFAOYSA-N
Mol Weight 154.25 g/mol
Molecular Formula C10H18O
Exact Mass 154.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8wo1tQ6zDv8
Name 4-tert-Butyl-cyclohexanone
CAS Registry Number 98-53-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H18O
InChI InChI=1S/C10H18O/c1-10(2,3)8-4-6-9(11)7-5-8/h8H,4-7H2,1-3H3
InChIKey YKFKEYKJGVSEIX-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference M.F. Grenier-Loustalot, P. Iratcabal, Org. Magn. Resonance 8, 544 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3