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4-(4-CHLOROPHENYL)-1-METHOXYCARBONYLMETHYL-PYRIMIDIN-1-IUM-BROMIDE

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4-(4-CHLOROPHENYL)-1-METHOXYCARBONYLMETHYL-PYRIMIDIN-1-IUM-BROMIDE
SpectraBase Compound ID AABnPctttCM
InChI InChI=1S/C13H12ClN2O2.BrH/c1-18-13(17)8-16-7-6-12(15-9-16)10-2-4-11(14)5-3-10;/h2-7,9H,8H2,1H3;1H/q+1;/p-1
InChIKey UEQCSAQLFSUZNF-UHFFFAOYSA-M
Mol Weight 343.61 g/mol
Molecular Formula C13H12BrClN2O2
Exact Mass 341.977068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2FnDzECMIg
Name 4-(4-CHLOROPHENYL)-1-METHOXYCARBONYLMETHYL-PYRIMIDIN-1-IUM-BROMIDE
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12BrClN2O2
InChI InChI=1S/C13H12ClN2O2.BrH/c1-18-13(17)8-16-7-6-12(15-9-16)10-2-4-11(14)5-3-10;/h2-7,9H,8H2,1H3;1H/q+1;/p-1
InChIKey UEQCSAQLFSUZNF-UHFFFAOYSA-M
Literature Reference Author G.ZBANCIOC,V.BEJAN,M.RISCA,C.MOLDOVEANU,I.I.MANGALAGIU
Literature Reference Citation MOLECULES,14,403(2009)
Literature Reference DOI 10.3390/molecules14010403
Molecular Weight 343.607 g/mol
Sample ID 69092
Solvent CDCl3