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5,5-Dimethyl-2-ethyl-2-(1-naphthylmethyl)-1,3-cyclohexanedione

View entire compound with spectra: 1 NMR, and 1 UV-Vis

5,5-Dimethyl-2-ethyl-2-(1-naphthylmethyl)-1,3-cyclohexanedione
SpectraBase Compound ID Ek1fPIjE4tC
InChI InChI=1S/C21H24O2/c1-4-21(18(22)13-20(2,3)14-19(21)23)12-16-10-7-9-15-8-5-6-11-17(15)16/h5-11H,4,12-14H2,1-3H3
InChIKey YBCOMIGFRDDTDR-UHFFFAOYSA-N
Mol Weight 308.42 g/mol
Molecular Formula C21H24O2
Exact Mass 308.17763 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FkeFp99lWOw
Name 5,5-Dimethyl-2-ethyl-2-(1-naphthylmethyl)-1,3-cyclohexanedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.177630011 u
Formula C21H24O2
InChI InChI=1S/C21H24O2/c1-4-21(18(22)13-20(2,3)14-19(21)23)12-16-10-7-9-15-8-5-6-11-17(15)16/h5-11H,4,12-14H2,1-3H3
InChIKey YBCOMIGFRDDTDR-UHFFFAOYSA-N
Molecular Weight 308.421 g/mol
SMILES C1C(C(C(CC1(C)C)=O)(CC)CC=1C=2C=CC=CC2C=CC1)=O