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Cyclohexyl 4-(4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

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Cyclohexyl 4-(4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID iomZdbj5Ps
InChI InChI=1S/C26H33NO4/c1-16-22(25(29)31-19-8-6-5-7-9-19)23(17-10-12-18(30-4)13-11-17)24-20(27-16)14-26(2,3)15-21(24)28/h10-13,19,23,27H,5-9,14-15H2,1-4H3
InChIKey PIGUGUNPRRTJGI-UHFFFAOYSA-N
Mol Weight 423.6 g/mol
Molecular Formula C26H33NO4
Exact Mass 423.240959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LYUvOgIAb9t
Name Cyclohexyl 4-(4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 423.240958543 u
Formula C26H33NO4
InChI InChI=1S/C26H33NO4/c1-16-22(25(29)31-19-8-6-5-7-9-19)23(17-10-12-18(30-4)13-11-17)24-20(27-16)14-26(2,3)15-21(24)28/h10-13,19,23,27H,5-9,14-15H2,1-4H3
InChIKey PIGUGUNPRRTJGI-UHFFFAOYSA-N
Molecular Weight 423.553 g/mol
SMILES N1C2=C(C(C(=C1C)C(OC1CCCCC1)=O)C1=CC=C(C=C1)OC)C(CC(C2)(C)C)=O