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(1RS,10BRS)-1-[(1RS)-1,5-DIMETHYLHEXYL]-1,2,6,10B,11,12-HEXAHYDRO-5H-IMIDAZO-[1',2':1,2]-PYRIMIDO-[4,3-A]-ISOQUINOLINE-HYDROCHLORIDE;IS1

View entire compound with spectra: 2 NMR

(1RS,10BRS)-1-[(1RS)-1,5-DIMETHYLHEXYL]-1,2,6,10B,11,12-HEXAHYDRO-5H-IMIDAZO-[1',2':1,2]-PYRIMIDO-[4,3-A]-ISOQUINOLINE-HYDROCHLORIDE;IS1
SpectraBase Compound ID Gw85swRlt5n
InChI InChI=1S/C22H33N3.ClH/c1-16(2)7-6-8-17(3)21-15-23-22-24-13-11-18-9-4-5-10-19(18)20(24)12-14-25(21)22;/h4-5,9-10,16-17,20-21H,6-8,11-15H2,1-3H3;1H
InChIKey RGHFDVGXNSQCMZ-UHFFFAOYSA-N
Mol Weight 376.0 g/mol
Molecular Formula C22H34ClN3
Exact Mass 375.244126 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CNabJL5yID0
Name (1RS,10BRS)-1-[(1RS)-1,5-DIMETHYLHEXYL]-1,2,6,10B,11,12-HEXAHYDRO-5H-IMIDAZO-[1',2':1,2]-PYRIMIDO-[4,3-A]-ISOQUINOLINE-HYDROCHLORIDE;IS1
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34ClN3
InChI InChI=1S/C22H33N3.ClH/c1-16(2)7-6-8-17(3)21-15-23-22-24-13-11-18-9-4-5-10-19(18)20(24)12-14-25(21)22;/h4-5,9-10,16-17,20-21H,6-8,11-15H2,1-3H3;1H
InChIKey RGHFDVGXNSQCMZ-UHFFFAOYSA-N
Literature Reference Author E.GOESSNITZER,A.PUNKENHOFER
Literature Reference Citation MH.CHEM.,134,1271(2003)
Literature Reference DOI 10.1007/s00706-003-0038-9
Molecular Weight 375.985 g/mol
Solvent DMSO-D6
Source File Reference UWKP5124