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Hexane, 1,6-bis(3-nitrobenzylidenamino)-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Hexane, 1,6-bis(3-nitrobenzylidenamino)-
SpectraBase Compound ID CtvIir10yCQ
InChI InChI=1S/C20H22N4O4/c25-23(26)19-9-5-7-17(13-19)15-21-11-3-1-2-4-12-22-16-18-8-6-10-20(14-18)24(27)28/h5-10,13-16H,1-4,11-12H2/b21-15+,22-16+
InChIKey JYWRJFIEBKZZSB-YHARCJFQSA-N
Mol Weight 382.42 g/mol
Molecular Formula C20H22N4O4
Exact Mass 382.164105 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fu55tKRx4pa
Name Hexane, 1,6-bis(3-nitrobenzylidenamino)-
Comments Computed using HOSE algorithm
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Exact Mass 382.164105200 u
Formula C20H22N4O4
InChI InChI=1S/C20H22N4O4/c25-23(26)19-9-5-7-17(13-19)15-21-11-3-1-2-4-12-22-16-18-8-6-10-20(14-18)24(27)28/h5-10,13-16H,1-4,11-12H2/b21-15+,22-16+
InChIKey JYWRJFIEBKZZSB-YHARCJFQSA-N
Molecular Weight 382.420 g/mol
SMILES C(CC\N=C\C1=CC(=CC=C1)N(=O)=O)CCC\N=C\C1=CC=CC(=C1)N(=O)=O