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Cyclopentyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

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Cyclopentyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID 43aF8QC6bGy
InChI InChI=1S/C24H29NO3/c1-15-20(23(27)28-17-11-7-8-12-17)21(16-9-5-4-6-10-16)22-18(25-15)13-24(2,3)14-19(22)26/h4-6,9-10,17,21,25H,7-8,11-14H2,1-3H3
InChIKey HQBFDRDCJQWUDB-UHFFFAOYSA-N
Mol Weight 379.5 g/mol
Molecular Formula C24H29NO3
Exact Mass 379.214744 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bf0Z0MXOjsG
Name Cyclopentyl 2,7,7-trimethyl-5-oxo-4-phenyl-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 379.214743795 u
Formula C24H29NO3
InChI InChI=1S/C24H29NO3/c1-15-20(23(27)28-17-11-7-8-12-17)21(16-9-5-4-6-10-16)22-18(25-15)13-24(2,3)14-19(22)26/h4-6,9-10,17,21,25H,7-8,11-14H2,1-3H3
InChIKey HQBFDRDCJQWUDB-UHFFFAOYSA-N
Molecular Weight 379.500 g/mol
SMILES N1C2=C(C(C(=C1C)C(OC1CCCC1)=O)C=1C=CC=CC1)C(CC(C2)(C)C)=O