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2-Methylpropyl 2-oxo-4,6-diphenylcyclohex-3-ene-1-carboxylate

View entire compound with spectra: 1 NMR

2-Methylpropyl 2-oxo-4,6-diphenylcyclohex-3-ene-1-carboxylate
SpectraBase Compound ID BAgpCkRQ2yg
InChI InChI=1S/C23H24O3/c1-16(2)15-26-23(25)22-20(18-11-7-4-8-12-18)13-19(14-21(22)24)17-9-5-3-6-10-17/h3-12,14,16,20,22H,13,15H2,1-2H3
InChIKey YCHYQYLBFQBTJX-UHFFFAOYSA-N
Mol Weight 348.44 g/mol
Molecular Formula C23H24O3
Exact Mass 348.172545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8tMj1kYP6ud
Name 2-Methylpropyl 2-oxo-4,6-diphenylcyclohex-3-ene-1-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.172544630 u
Formula C23H24O3
InChI InChI=1S/C23H24O3/c1-16(2)15-26-23(25)22-20(18-11-7-4-8-12-18)13-19(14-21(22)24)17-9-5-3-6-10-17/h3-12,14,16,20,22H,13,15H2,1-2H3
InChIKey YCHYQYLBFQBTJX-UHFFFAOYSA-N
Molecular Weight 348.442 g/mol
SMILES C1=C(C=CC=C1)C=1CC(C(C(C1)=O)C(OCC(C)C)=O)C1=CC=CC=C1