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(S,S)-N,N'-Di(3-bromobenzylidene)cyclohexane-1,2-diamine

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(S,S)-N,N'-Di(3-bromobenzylidene)cyclohexane-1,2-diamine
SpectraBase Compound ID 9dsCqfIbWK0
InChI InChI=1S/C20H20Br2N2/c21-17-7-3-5-15(11-17)13-23-19-9-1-2-10-20(19)24-14-16-6-4-8-18(22)12-16/h3-8,11-14,19-20H,1-2,9-10H2/b23-13+,24-14+/t19-,20-/m0/s1
InChIKey ASCYEQYFVLCNQD-UKNKWABRSA-N
Mol Weight 448.2 g/mol
Molecular Formula C20H20Br2N2
Exact Mass 445.999325 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L7qdP7Iawtp
Name (S,S)-N,N'-di(3-Bromobenzylidene)cyclohexane-1,2-diamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 445.999324652 u
Formula C20H20Br2N2
InChI InChI=1S/C20H20Br2N2/c21-17-7-3-5-15(11-17)13-23-19-9-1-2-10-20(19)24-14-16-6-4-8-18(22)12-16/h3-8,11-14,19-20H,1-2,9-10H2/b23-13+,24-14+/t19-,20-/m0/s1
InChIKey ASCYEQYFVLCNQD-UKNKWABRSA-N
Molecular Weight 448.202 g/mol
SMILES [C@@]1([C@](CCCC1)(\N=C\C=1C=C(C=CC1)Br)[H])(\N=C\C=1C=C(C=CC1)Br)[H]