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3-AMINO-4-CYANO-1-OXO-[1,2,5,10]-TETRAHYDRO-AZEPINO-[3,4-B]-INDOLE
SpectraBase Compound ID IC8JwKDvAfz
InChI InChI=1S/C13H10N4O/c14-6-7-5-9-8-3-1-2-4-10(8)16-11(9)13(18)17-12(7)15/h1-4,16H,5,15H2,(H,17,18)
InChIKey AZGSNNXPSPYAQJ-UHFFFAOYSA-N
Mol Weight 238.25 g/mol
Molecular Formula C13H10N4O
Exact Mass 238.085461 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EydLO2zkycZ
Name 3-AMINO-4-CYANO-1-OXO-[1,2,5,10]-TETRAHYDRO-AZEPINO-[3,4-B]-INDOLE
Compound Number 12A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10N4O
InChI InChI=1S/C13H10N4O/c14-6-7-5-9-8-3-1-2-4-10(8)16-11(9)13(18)17-12(7)15/h1-4,16H,5,15H2,(H,17,18)
InChIKey AZGSNNXPSPYAQJ-UHFFFAOYSA-N
Literature Reference Author R.TROSCHUETZ,A.HOFFMANN
Literature Reference Citation J.HETCYCL.CHEM.,34,1431(1997)
Literature Reference DOI 10.1002/jhet.5570340510
Molecular Weight 238.249 g/mol
Solvent DMSO-D6
Source File Reference UWSW624