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5,8-ETHANO-2-METHYL-1-(3,4,5-TRIMETHOXYBENZYL)-1,2,3,4,5,6,7,8-OCTAHYDROISOQUINOLINE
SpectraBase Compound ID g9EloSO2D2
InChI InChI=1S/C22H31NO3/c1-23-10-9-17-15-5-7-16(8-6-15)21(17)18(23)11-14-12-19(24-2)22(26-4)20(13-14)25-3/h12-13,15-16,18H,5-11H2,1-4H3/t15-,16+,18?
InChIKey IRSOPDBJHAXLLI-BYICEURKSA-N
Mol Weight 357.49 g/mol
Molecular Formula C22H31NO3
Exact Mass 357.230394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CG8PMhnwjxq
Name 5,8-ETHANO-2-METHYL-1-(3,4,5-TRIMETHOXYBENZYL)-1,2,3,4,5,6,7,8-OCTAHYDROISOQUINOLINE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H31NO3
InChI InChI=1S/C22H31NO3/c1-23-10-9-17-15-5-7-16(8-6-15)21(17)18(23)11-14-12-19(24-2)22(26-4)20(13-14)25-3/h12-13,15-16,18H,5-11H2,1-4H3/t15-,16+,18?
InChIKey IRSOPDBJHAXLLI-BYICEURKSA-N
Literature Reference Author S.L.SAHA,V.F.ROCHE,K.PENDOLA,M.KEARLEY,L.LEI,K.J.ROMSTEDT,M. HERDMAN,G.SHAMS,V.KA
Literature Reference Citation BIOORG.MED.CHEM.,10,2779(2002)
Literature Reference DOI 10.1016/S0968-0896(02)00101-3
Molecular Weight 357.493 g/mol
Solvent CDCl3
Source File Reference UWSI24362