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TRANS-(Z)-3-(ALPHA-CYANO-ALPHA-ETHOXYCARBONYL-ETHYLENE)-OCTAHYDRO-2(1H)-QUINOXALINE
SpectraBase Compound ID AxyvdrykvZk
InChI InChI=1S/C13H17N3O3/c1-2-19-13(18)8(7-14)11-12(17)16-10-6-4-3-5-9(10)15-11/h9-10,15H,2-6H2,1H3,(H,16,17)/b11-8-/t9-,10-/m0/s1
InChIKey OHCLWTRRSHPHNI-YNMOXFEVSA-N
Mol Weight 263.3 g/mol
Molecular Formula C13H17N3O3
Exact Mass 263.126991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8EJRTNhdwuN
Name TRANS-(Z)-3-(ALPHA-CYANO-ALPHA-ETHOXYCARBONYL-ETHYLENE)-OCTAHYDRO-2(1H)-QUINOXALINE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H17N3O3
InChI InChI=1S/C13H17N3O3/c1-2-19-13(18)8(7-14)11-12(17)16-10-6-4-3-5-9(10)15-11/h9-10,15H,2-6H2,1H3,(H,16,17)/b11-8-/t9-,10-/m0/s1
InChIKey OHCLWTRRSHPHNI-YNMOXFEVSA-N
Literature Reference Author Y.YAMADA,H.YASUDA,M.KASAI
Literature Reference Citation HETEROCYCLES,51,2453(1999)
Literature Reference DOI 10.3987/COM-99-8645
Molecular Weight 263.296 g/mol
Solvent DMSO-D6
Source File Reference UWSW167