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3-[4-(4-BROMOBENZYLOXY)-BENZOYL]-1,2,3,4-TETRAHYDRO-8-METHYL-2H-PYRIDO-[1,2-A]-PYRIMIDINE-HYDROCHLORIDE
SpectraBase Compound ID 2fAllBvQuUE
InChI InChI=1S/C23H21BrN2O2.ClH/c1-16-10-11-26-14-19(13-25-22(26)12-16)23(27)18-4-8-21(9-5-18)28-15-17-2-6-20(24)7-3-17;/h2-12,19H,13-15H2,1H3;1H
InChIKey ZVMSEZOROAZXMS-UHFFFAOYSA-N
Mol Weight 473.8 g/mol
Molecular Formula C23H22BrClN2O2
Exact Mass 472.055319 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID P17SGErHmM
Name 3-[4-(4-BROMOBENZYLOXY)-BENZOYL]-1,2,3,4-TETRAHYDRO-8-METHYL-2H-PYRIDO-[1,2-A]-PYRIMIDINE-HYDROCHLORIDE
Compound Number 6P
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H22BrClN2O2
InChI InChI=1S/C23H21BrN2O2.ClH/c1-16-10-11-26-14-19(13-25-22(26)12-16)23(27)18-4-8-21(9-5-18)28-15-17-2-6-20(24)7-3-17;/h2-12,19H,13-15H2,1H3;1H
InChIKey ZVMSEZOROAZXMS-UHFFFAOYSA-N
Literature Reference Author U.GIRRESER,U.BLUHM,B.CLEMENT,D.HEBER
Literature Reference Citation MAGN.RES.CHEM.,51,714(2013)
Molecular Weight 473.797 g/mol
Solvent DMSO-D6
Source File Reference UWIR13245