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Methyl 2,7,7-trimethyl-4-(5-methyl-2-thienyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

View entire compound with spectra: 3 NMR

Methyl 2,7,7-trimethyl-4-(5-methyl-2-thienyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID 8vFuCwxJfgR
InChI InChI=1S/C19H23NO3S/c1-10-6-7-14(24-10)17-15(18(22)23-5)11(2)20-12-8-19(3,4)9-13(21)16(12)17/h6-7,17,20H,8-9H2,1-5H3
InChIKey LEICLIPEAKWWBC-UHFFFAOYSA-N
Mol Weight 345.46 g/mol
Molecular Formula C19H23NO3S
Exact Mass 345.139865 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HbafNQKHiMp
Name Methyl 2,7,7-trimethyl-4-(5-methyl-2-thienyl)-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 345.139864776 u
Formula C19H23NO3S
InChI InChI=1S/C19H23NO3S/c1-10-6-7-14(24-10)17-15(18(22)23-5)11(2)20-12-8-19(3,4)9-13(21)16(12)17/h6-7,17,20H,8-9H2,1-5H3
InChIKey LEICLIPEAKWWBC-UHFFFAOYSA-N
Molecular Weight 345.457 g/mol
SMILES N1C(=C(C(C=2C(CC(CC12)(C)C)=O)C=1SC(C)=CC1)C(=O)OC)C