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CIS-2,6-DICYANO-4-AZATRICYCLO[5.2.2.0(2,6)]UNDEC-8-ENE-3,5-DIONE
SpectraBase Compound ID GmDTsVnkx0x
InChI InChI=1S/C12H9N3O2/c13-5-11-7-1-2-8(4-3-7)12(11,6-14)10(17)15-9(11)16/h1-2,7-8H,3-4H2,(H,15,16,17)/t7-,8+,11+,12-
InChIKey FAGSLJFCHIOLDZ-IVQVNHIISA-N
Mol Weight 227.22 g/mol
Molecular Formula C12H9N3O2
Exact Mass 227.069477 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 77maBETrl0q
Name CIS-2,6-DICYANO-4-AZATRICYCLO[5.2.2.0(2,6)]UNDEC-8-ENE-3,5-DIONE
Comments ST
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H9N3O2
InChI InChI=1S/C12H9N3O2/c13-5-11-7-1-2-8(4-3-7)12(11,6-14)10(17)15-9(11)16/h1-2,7-8H,3-4H2,(H,15,16,17)/t7-,8+,11+,12-
InChIKey FAGSLJFCHIOLDZ-IVQVNHIISA-N
Instrument Name Bruker WH-90
Literature Reference O.E.NASAKIN, A.N.LYSCHIKOV, P.M.LUKIN, S.V.KONOVALIKHIN, A.KH.BULAI,P.B.TERENT'EV, A.B.ZOLOTOI, A.P.PLESHKOVA (1993) Izv.Akad.Nauk SSSR(Russ.Lang.): N3, 534-538.
NMR Standard HMDS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo