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N,N'-[bis(Benzylamino)ethanediylidene]bis-p-toluenesulfonamide
SpectraBase Compound ID E9wV5RLMdBf
InChI InChI=1S/C30H30N4O4S2/c1-23-13-17-27(18-14-23)39(35,36)33-29(31-21-25-9-5-3-6-10-25)30(32-22-26-11-7-4-8-12-26)34-40(37,38)28-19-15-24(2)16-20-28/h3-20H,21-22H2,1-2H3,(H,31,33)(H,32,34)
InChIKey RHXUCNCGZLCTAM-UHFFFAOYSA-N
Mol Weight 574.71 g/mol
Molecular Formula C30H30N4O4S2
Exact Mass 574.170848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AoOvYyb4bk6
Name N,N'-[bis(Benzylamino)ethanediylidene]bis-p-toluenesulfonamide
Comments Computed using HOSE algorithm
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Exact Mass 574.170847806 u
Formula C30H30N4O4S2
InChI InChI=1S/C30H30N4O4S2/c1-23-13-17-27(18-14-23)39(35,36)33-29(31-21-25-9-5-3-6-10-25)30(32-22-26-11-7-4-8-12-26)34-40(37,38)28-19-15-24(2)16-20-28/h3-20H,21-22H2,1-2H3,(H,31,33)(H,32,34)
InChIKey RHXUCNCGZLCTAM-UHFFFAOYSA-N
Molecular Weight 574.714 g/mol
SMILES N(CC=1C=CC=CC1)\C(\C(NCC1=CC=CC=C1)=N/S(C=1C=CC(C)=CC1)(=O)=O)=N/S(C1=CC=C(C)C=C1)(=O)=O