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Isopropyl 4-(4-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

View entire compound with spectra: 2 NMR

Isopropyl 4-(4-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID EPbVVU8HExx
InChI InChI=1S/C20H22BrNO3/c1-11(2)25-20(24)17-12(3)22-15-5-4-6-16(23)19(15)18(17)13-7-9-14(21)10-8-13/h7-11,18,22H,4-6H2,1-3H3
InChIKey YXAJQJMVPRELMH-UHFFFAOYSA-N
Mol Weight 404.3 g/mol
Molecular Formula C20H22BrNO3
Exact Mass 403.078307 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11Hrf9bpgmj
Name Isopropyl 4-(4-bromophenyl)-2-methyl-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 403.078306569 u
Formula C20H22BrNO3
InChI InChI=1S/C20H22BrNO3/c1-11(2)25-20(24)17-12(3)22-15-5-4-6-16(23)19(15)18(17)13-7-9-14(21)10-8-13/h7-11,18,22H,4-6H2,1-3H3
InChIKey YXAJQJMVPRELMH-UHFFFAOYSA-N
Molecular Weight 404.304 g/mol
SMILES N1C2=C(C(C(=C1C)C(OC(C)C)=O)C1=CC=C(C=C1)Br)C(CCC2)=O