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3-ETHOXYCARBONYL-4-PHENYL-1,4,5,6,7,8-HEXAHYDRO-2,7,7-TRIMETHYL-5-OXOQUINOLINE
SpectraBase Compound ID DfDi90C8eNd
InChI InChI=1S/C21H25NO3/c1-5-25-20(24)17-13(2)22-15-11-21(3,4)12-16(23)19(15)18(17)14-9-7-6-8-10-14/h6-10,18,22H,5,11-12H2,1-4H3
InChIKey BHUYANTVBSTZDM-UHFFFAOYSA-N
Mol Weight 339.44 g/mol
Molecular Formula C21H25NO3
Exact Mass 339.183444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IoVQVkbV7tX
Name 3-ETHOXYCARBONYL-4-PHENYL-1,4,5,6,7,8-HEXAHYDRO-2,7,7-TRIMETHYL-5-OXOQUINOLINE
Compound Number 1G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H25NO3
InChI InChI=1S/C21H25NO3/c1-5-25-20(24)17-13(2)22-15-11-21(3,4)12-16(23)19(15)18(17)14-9-7-6-8-10-14/h6-10,18,22H,5,11-12H2,1-4H3
InChIKey BHUYANTVBSTZDM-UHFFFAOYSA-N
Literature Reference Author E.SALFRAN,M.SUAREZ,D.MOLERO,R.MARTINEZ-ALVAREZ,Y.VERDECIA,E. OCHOA,A.ALVAREZ,C.SE
Literature Reference Citation MAGN.RES.CHEM.,44,637(2006)
Literature Reference DOI 10.1002/mrc.1784
Molecular Weight 339.434 g/mol
Sample ID 43729
Solvent DMSO-D6