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7-ALPHA-(4-CHLOROPHENYL)-TRANS-8A-BETA-5,6,8A,9,10,11,12,12A-OCTAHYDROBENZIMIDAZO-[2,1-B]-BENZO-[H]-QUINAZOLINE-HYDROCHLORIDE

View entire compound with spectra: 1 NMR

7-ALPHA-(4-CHLOROPHENYL)-TRANS-8A-BETA-5,6,8A,9,10,11,12,12A-OCTAHYDROBENZIMIDAZO-[2,1-B]-BENZO-[H]-QUINAZOLINE-HYDROCHLORIDE
SpectraBase Compound ID 7Ls0lLsLoyD
InChI InChI=1S/C24H24ClN3.ClH/c25-17-12-9-16(10-13-17)23-19-14-11-15-5-1-2-6-18(15)22(19)27-24-26-20-7-3-4-8-21(20)28(23)24;/h1-2,5-6,9-10,12-13,20-21,23H,3-4,7-8,11,14H2,(H,26,27);1H/t20-,21-,23+;/m0./s1
InChIKey XOWQFBUAMOWKPS-XVGZVFJZSA-N
Mol Weight 426.39 g/mol
Molecular Formula C24H25Cl2N3
Exact Mass 425.142553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4LzgxtWg2Dm
Name 7-ALPHA-(4-CHLOROPHENYL)-TRANS-8A-BETA-5,6,8A,9,10,11,12,12A-OCTAHYDROBENZIMIDAZO-[2,1-B]-BENZO-[H]-QUINAZOLINE-HYDROCHLORIDE
Compound Number 5EC*HCL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H25Cl2N3
InChI InChI=1S/C24H24ClN3.ClH/c25-17-12-9-16(10-13-17)23-19-14-11-15-5-1-2-6-18(15)22(19)27-24-26-20-7-3-4-8-21(20)28(23)24;/h1-2,5-6,9-10,12-13,20-21,23H,3-4,7-8,11,14H2,(H,26,27);1H/t20-,21-,23+;/m0./s1
InChIKey XOWQFBUAMOWKPS-XVGZVFJZSA-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 426.389 g/mol
Solvent DMSO-D6
Source File Reference UWRU1273