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1,3-DIMETHYL-8-(QUINUCLIDYL-3)XANTHINE HYDROCHLORIDE
SpectraBase Compound ID J3EMuXiKzAq
InChI InChI=1S/C14H19N5O2.ClH/c1-17-12-10(13(20)18(2)14(17)21)15-11(16-12)9-7-19-5-3-8(9)4-6-19;/h8-9H,3-7H2,1-2H3,(H,15,16);1H
InChIKey QZXWFKDZORUHCW-UHFFFAOYSA-N
Mol Weight 325.8 g/mol
Molecular Formula C14H20ClN5O2
Exact Mass 325.130553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kflls7vrb0u
Name 1,3-DIMETHYL-8-(QUINUCLIDYL-3)XANTHINE HYDROCHLORIDE
Comments lf
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Formula C14H20ClN5O2
InChI InChI=1S/C14H19N5O2.ClH/c1-17-12-10(13(20)18(2)14(17)21)15-11(16-12)9-7-19-5-3-8(9)4-6-19;/h8-9H,3-7H2,1-2H3,(H,15,16);1H
InChIKey QZXWFKDZORUHCW-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference G.P.ZHIKHAREVA, L.N.YAKHONTOV, M.F.MARSHALKIN, K.F.TURCHIN, E.F.KULESHOVA,YU.N.SHEINKER (1991) Khim.Farm.Zhurn.(Russ. Lang.): v.25, N1, 32-36.
NMR Standard C4H8O2
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O deuterium oxide