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4-CYANIMINO-1,2,3,4,6,7,12,12B-OCTAHYDRO-3,12B-ETHANOPYRIMIDO-[1',6':1,2]-PYRIDO-[3,4-B]-INDOLE
SpectraBase Compound ID LqFABHKxlKI
InChI InChI=1S/C17H17N5/c18-11-19-16-21-9-6-17(7-10-21)15-13(5-8-22(16)17)12-3-1-2-4-14(12)20-15/h1-4,20H,5-10H2/b19-16+
InChIKey KTWRLTOXXXTUDY-KNTRCKAVSA-N
Mol Weight 291.36 g/mol
Molecular Formula C17H17N5
Exact Mass 291.148396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5sjDF4Q3LZL
Name 4-CYANIMINO-1,2,3,4,6,7,12,12B-OCTAHYDRO-3,12B-ETHANOPYRIMIDO-[1',6':1,2]-PYRIDO-[3,4-B]-INDOLE
Compound Number 5
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17N5
InChI InChI=1S/C17H17N5/c18-11-19-16-21-9-6-17(7-10-21)15-13(5-8-22(16)17)12-3-1-2-4-14(12)20-15/h1-4,20H,5-10H2/b19-16+
InChIKey KTWRLTOXXXTUDY-KNTRCKAVSA-N
Literature Reference Author G.DOMANY,T.GIZUR,G.BARTA-SZALAI,I.SCHOEN,C.SZANTAY,B.HEGEDUE S
Literature Reference Citation J.HETCYCL.CHEM.,31,1657(1994)
Literature Reference DOI 10.1002/jhet.5570310664
Molecular Weight 291.355 g/mol
Solvent DMSO-D6
Source File Reference UWCS19710