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1-METHYL-8-BENZYL-2,3,6,7,8,9-HEXAHYDRO-IMIDAZO-[2',1':3,4]-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDIN-9(1H)-ONE
SpectraBase Compound ID 8QxmkrSkOnt
InChI InChI=1S/C18H20N6O/c1-21-9-10-23-17-19-15-12-22(11-13-5-3-2-4-6-13)8-7-14(15)16(25)24(17)20-18(21)23/h2-6H,7-12H2,1H3
InChIKey LTHBLAOTBCCVDH-UHFFFAOYSA-N
Mol Weight 336.4 g/mol
Molecular Formula C18H20N6O
Exact Mass 336.169859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Chn2nbfhrHA
Name 1-METHYL-8-BENZYL-2,3,6,7,8,9-HEXAHYDRO-IMIDAZO-[2',1':3,4]-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDIN-9(1H)-ONE
Compound Number 2E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20N6O
InChI InChI=1S/C18H20N6O/c1-21-9-10-23-17-19-15-12-22(11-13-5-3-2-4-6-13)8-7-14(15)16(25)24(17)20-18(21)23/h2-6H,7-12H2,1H3
InChIKey LTHBLAOTBCCVDH-UHFFFAOYSA-N
Literature Reference Author G.BERECZ,J.REITER,G.ARGAY,A.KALMAN
Literature Reference Citation J.HETCYCL.CHEM.,39,319(2002)
Literature Reference DOI 10.1002/jhet.5570390213
Molecular Weight 336.396 g/mol
Solvent CDCl3
Source File Reference UWSI8568