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4-IMINO-3-AMINO-2-METHYL-6,7,8,9-TETRAHYDRO-4H,5H-CYCLOHEPTA-[4,5]-THIENO-[2,3-D]-PYRIMIDINE
SpectraBase Compound ID 9nFMiXI6Esh
InChI InChI=1S/C12H16N4S/c1-7-15-12-10(11(13)16(7)14)8-5-3-2-4-6-9(8)17-12/h13H,2-6,14H2,1H3
InChIKey BDFKSRVMOUYJTA-UHFFFAOYSA-N
Mol Weight 248.35 g/mol
Molecular Formula C12H16N4S
Exact Mass 248.109568 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4XvbTTtjJUt
Name 4-IMINO-3-AMINO-2-METHYL-6,7,8,9-TETRAHYDRO-4H,5H-CYCLOHEPTA-[4,5]-THIENO-[2,3-D]-PYRIMIDINE
Compound Number 39
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16N4S
InChI InChI=1S/C12H16N4S/c1-7-15-12-10(11(13)16(7)14)8-5-3-2-4-6-9(8)17-12/h13H,2-6,14H2,1H3
InChIKey BDFKSRVMOUYJTA-UHFFFAOYSA-N
Literature Reference Author K.M.AL-TAISAN,H.M.A.AL-HAZIMI,S.S.AL-SHIHRY
Literature Reference Citation MOLECULES,15,3932(2010)
Literature Reference DOI 10.3390/molecules15063932
Molecular Weight 248.346 g/mol
Sample ID 70979
Solvent CDCl3