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5,8-ETHANO-2-(PARA-METHOXYBENZYL)-1-(PARA-METHYLBENZYL)-1,2,3,4,5,6,7,8-OCTAHYDROISOQUINOLINE
SpectraBase Compound ID 7mnhoPD2NUy
InChI InChI=1S/C27H33NO/c1-19-3-5-20(6-4-19)17-26-27-23-11-9-22(10-12-23)25(27)15-16-28(26)18-21-7-13-24(29-2)14-8-21/h3-8,13-14,22-23,26H,9-12,15-18H2,1-2H3/t22-,23+,26?
InChIKey UJWHNIFWTXJSFB-XZQOPNAISA-N
Mol Weight 387.6 g/mol
Molecular Formula C27H33NO
Exact Mass 387.256215 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6oAWpZsqSbS
Name 5,8-ETHANO-2-(PARA-METHOXYBENZYL)-1-(PARA-METHYLBENZYL)-1,2,3,4,5,6,7,8-OCTAHYDROISOQUINOLINE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H33NO
InChI InChI=1S/C27H33NO/c1-19-3-5-20(6-4-19)17-26-27-23-11-9-22(10-12-23)25(27)15-16-28(26)18-21-7-13-24(29-2)14-8-21/h3-8,13-14,22-23,26H,9-12,15-18H2,1-2H3/t22-,23+,26?
InChIKey UJWHNIFWTXJSFB-XZQOPNAISA-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 387.565 g/mol
Solvent CDCl3
Source File Reference UWSI24365