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N,N'-BIS-[[1-(N-HEXYL)-3-METHYL-5-OXO-2-PYRAZOLIN-4-YLETHYLIDEN]-1-YL]-TRANS-1,2-DIAMINOCYCLOHEXANE

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N,N'-BIS-[[1-(N-HEXYL)-3-METHYL-5-OXO-2-PYRAZOLIN-4-YLETHYLIDEN]-1-YL]-TRANS-1,2-DIAMINOCYCLOHEXANE
SpectraBase Compound ID 3jEUbzxSHdc
InChI InChI=1S/C30H50N6O2/c1-7-9-11-15-19-35-29(37)27(23(5)33-35)21(3)31-25-17-13-14-18-26(25)32-22(4)28-24(6)34-36(30(28)38)20-16-12-10-8-2/h25-26,31-32H,7-20H2,1-6H3/b27-21+,28-22+
InChIKey JFAMAZGBKSMGJG-GPAWKIAZSA-N
Mol Weight 526.8 g/mol
Molecular Formula C30H50N6O2
Exact Mass 526.399525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8aG5B4DQaMm
Name N,N'-BIS-[[1-(N-HEXYL)-3-METHYL-5-OXO-2-PYRAZOLIN-4-YLETHYLIDEN]-1-YL]-TRANS-1,2-DIAMINOCYCLOHEXANE
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50N6O2
InChI InChI=1S/C30H50N6O2/c1-7-9-11-15-19-35-29(37)27(23(5)33-35)21(3)31-25-17-13-14-18-26(25)32-22(4)28-24(6)34-36(30(28)38)20-16-12-10-8-2/h25-26,31-32H,7-20H2,1-6H3/b27-21+,28-22+
InChIKey JFAMAZGBKSMGJG-GPAWKIAZSA-N
Literature Reference Author J.BELMAR,F.R.PEREZ,J.ALDERETE,C.ZUNIGA
Literature Reference Citation J.BRAZ.CHEM.SOC.,16,179(2005)
Molecular Weight 526.766 g/mol
Solvent CDCl3
Source File Reference UWLU7075