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5,8-ETHANO-1-(PARA-CHLOROBENZYL)-2-(PARA-METHOXYBENZYL)-1,2,3,4,5,6,7,8-OCTAHYDROISOQUINOLINE
SpectraBase Compound ID Cz00N6Z6aj6
InChI InChI=1S/C26H30ClNO/c1-29-23-12-4-19(5-13-23)17-28-15-14-24-20-6-8-21(9-7-20)26(24)25(28)16-18-2-10-22(27)11-3-18/h2-5,10-13,20-21,25H,6-9,14-17H2,1H3/t20-,21+,25?
InChIKey BXJXPAHOCNICQR-KEVCNVLYSA-N
Mol Weight 407.99 g/mol
Molecular Formula C26H30ClNO
Exact Mass 407.201592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ausujHFMZv
Name 5,8-ETHANO-1-(PARA-CHLOROBENZYL)-2-(PARA-METHOXYBENZYL)-1,2,3,4,5,6,7,8-OCTAHYDROISOQUINOLINE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H30ClNO
InChI InChI=1S/C26H30ClNO/c1-29-23-12-4-19(5-13-23)17-28-15-14-24-20-6-8-21(9-7-20)26(24)25(28)16-18-2-10-22(27)11-3-18/h2-5,10-13,20-21,25H,6-9,14-17H2,1H3/t20-,21+,25?
InChIKey BXJXPAHOCNICQR-KEVCNVLYSA-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 407.983 g/mol
Solvent CDCl3
Source File Reference UWSI24364