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TRANS-6A-ALPHA-12-ALPHA-PHENYL-1,2,3,4,5,6A,7,8,9,10,10A,12-DODECAHYDROBENZIMIDAZO-[2,1-B]-QUINAZOLINE-HYDROCHLORIDE
SpectraBase Compound ID DjAVgP0mzyp
InChI InChI=1S/C20H25N3.ClH/c1-2-8-14(9-3-1)19-15-10-4-5-11-16(15)21-20-22-17-12-6-7-13-18(17)23(19)20;/h1-3,8-9,17-19H,4-7,10-13H2,(H,21,22);1H/t17-,18-,19+;/m0./s1
InChIKey VGPMLYOMQSJNLN-OXJRKUMDSA-N
Mol Weight 343.9 g/mol
Molecular Formula C20H26ClN3
Exact Mass 343.181526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5HMItKi7aBi
Name TRANS-6A-ALPHA-12-ALPHA-PHENYL-1,2,3,4,5,6A,7,8,9,10,10A,12-DODECAHYDROBENZIMIDAZO-[2,1-B]-QUINAZOLINE-HYDROCHLORIDE
Compound Number 4CC*HCL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H26ClN3
InChI InChI=1S/C20H25N3.ClH/c1-2-8-14(9-3-1)19-15-10-4-5-11-16(15)21-20-22-17-12-6-7-13-18(17)23(19)20;/h1-3,8-9,17-19H,4-7,10-13H2,(H,21,22);1H/t17-,18-,19+;/m0./s1
InChIKey VGPMLYOMQSJNLN-OXJRKUMDSA-N
Literature Reference Author W.WENDELIN,E.GOESSNITZER,D.A.E.ELLA
Literature Reference Citation MH.CHEM.,131,353(2000)
Literature Reference DOI 10.1007/s007060050317
Molecular Weight 343.900 g/mol
Solvent DMSO-D6
Source File Reference UWRU1263