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1-HEXYLOXY-8-METHYL-3,6,10,13,16,19-HEXAAZABICYClO-[6.6.6]-ICOSANYL-COBALTCHLORIDE-III;1-HEXYLOXY-8-METHYL-SARCOPHAGINYL-COBALTCHLORIDE-III
SpectraBase Compound ID 9hQdrjorvjS
InChI InChI=1S/C21H40N6O.3ClH.Co/c1-3-4-5-6-13-28-21-17-25-10-7-22-14-20(2,15-23-8-11-26-18-21)16-24-9-12-27-19-21;;;;/h3-19H2,1-2H3;3*1H;/q-6;;;;+9/p-3/t20-,21-;;;;
InChIKey YOVLCINGXOBWSS-DMNDFULXSA-K
Mol Weight 557.9 g/mol
Molecular Formula C21H40Cl3CoN6O
Exact Mass 556.166112 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FMQzwHpg7Pk
Name 1-HEXYLOXY-8-METHYL-3,6,10,13,16,19-HEXAAZABICYClO-[6.6.6]-ICOSANYL-COBALTCHLORIDE-III;1-HEXYLOXY-8-METHYL-SARCOPHAGINYL-COBALTCHLORIDE-III
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H40Cl3CoN6O
InChI InChI=1S/C21H40N6O.3ClH.Co/c1-3-4-5-6-13-28-21-17-25-10-7-22-14-20(2,15-23-8-11-26-18-21)16-24-9-12-27-19-21;;;;/h3-19H2,1-2H3;3*1H;/q-6;;;;+9/p-3/t20-,21-;;;;
InChIKey YOVLCINGXOBWSS-DMNDFULXSA-K
Literature Reference Author C.A.BEHM,P.F.L.BOREHAM,I.I.CREASER,B.KORYBUT-DASZKIEWICZ,D.J .MADDALENA,A.M.SARGE
Literature Reference Citation AUSTR.J.CHEM.,48,1009(1995)
Literature Reference DOI 10.1071/ch9951009
Molecular Weight 557.880 g/mol
Solvent D2O
Source File Reference UWRK3136