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(Z)-5-Acetoxy-6,6-dimethyl-1,3-diphenyl-4-hepten-1-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(Z)-5-Acetoxy-6,6-dimethyl-1,3-diphenyl-4-hepten-1-one
SpectraBase Compound ID LQ2Lsp0C6Wk
InChI InChI=1S/C23H26O3/c1-17(24)26-22(23(2,3)4)16-20(18-11-7-5-8-12-18)15-21(25)19-13-9-6-10-14-19/h5-14,16,20H,15H2,1-4H3/b22-16-
InChIKey LLOGFHLSEXQGOA-JWGURIENSA-N
Mol Weight 350.46 g/mol
Molecular Formula C23H26O3
Exact Mass 350.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5IsCOR99hYX
Name (Z)-5-Acetoxy-6,6-dimethyl-1,3-diphenyl-4-hepten-1-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.188194694 u
Formula C23H26O3
InChI InChI=1S/C23H26O3/c1-17(24)26-22(23(2,3)4)16-20(18-11-7-5-8-12-18)15-21(25)19-13-9-6-10-14-19/h5-14,16,20H,15H2,1-4H3/b22-16-
InChIKey LLOGFHLSEXQGOA-JWGURIENSA-N
Molecular Weight 350.458 g/mol
SMILES C(C)(\C(=C\C(C1=CC=CC=C1)CC(C1=CC=CC=C1)=O)OC(=O)C)(C)C