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3-(Dibenzylamino)-5,5-dimethyl-2-cyclohexen-1-one
SpectraBase Compound ID 3HOZ3q1CvGG
InChI InChI=1S/C22H25NO/c1-22(2)14-20(13-21(24)15-22)23(16-18-9-5-3-6-10-18)17-19-11-7-4-8-12-19/h3-13H,14-17H2,1-2H3
InChIKey UQSSKDVQQPOJJZ-UHFFFAOYSA-N
Mol Weight 319.45 g/mol
Molecular Formula C22H25NO
Exact Mass 319.193614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FTE1J4uzz7b
Name 3-(Dibenzylamino)-5,5-dimethyl-2-cyclohexen-1-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.193614428 u
Formula C22H25NO
InChI InChI=1S/C22H25NO/c1-22(2)14-20(13-21(24)15-22)23(16-18-9-5-3-6-10-18)17-19-11-7-4-8-12-19/h3-13H,14-17H2,1-2H3
InChIKey UQSSKDVQQPOJJZ-UHFFFAOYSA-N
Molecular Weight 319.448 g/mol
SMILES C1=C(CC(CC1=O)(C)C)N(CC=1C=CC=CC1)CC=1C=CC=CC1