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2-Allyl-5,5-dimethyl-2-(1-naphthylmethyl)-1,3-cyclohexanedione

View entire compound with spectra: 2 NMR, and 1 FTIR

2-Allyl-5,5-dimethyl-2-(1-naphthylmethyl)-1,3-cyclohexanedione
SpectraBase Compound ID GpF56s9cw2F
InChI InChI=1S/C22H24O2/c1-4-12-22(19(23)14-21(2,3)15-20(22)24)13-17-10-7-9-16-8-5-6-11-18(16)17/h4-11H,1,12-15H2,2-3H3
InChIKey QRPIARCDZUHCID-UHFFFAOYSA-N
Mol Weight 320.43 g/mol
Molecular Formula C22H24O2
Exact Mass 320.17763 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GhConq5vTfv
Name 2-Allyl-5,5-dimethyl-2-(1-naphthylmethyl)-1,3-cyclohexanedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.177630011 u
Formula C22H24O2
InChI InChI=1S/C22H24O2/c1-4-12-22(19(23)14-21(2,3)15-20(22)24)13-17-10-7-9-16-8-5-6-11-18(16)17/h4-11H,1,12-15H2,2-3H3
InChIKey QRPIARCDZUHCID-UHFFFAOYSA-N
Molecular Weight 320.432 g/mol
SMILES C=12C=CC=CC1C(=CC=C2)CC1(C(CC(CC1=O)(C)C)=O)CC=C