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1,6-bis(p-Cumenyl)-2,5-dithiobiurea

View entire compound with spectra: 2 NMR, 1 FTIR, and 2 UV-Vis

1,6-bis(p-Cumenyl)-2,5-dithiobiurea
SpectraBase Compound ID IDnT2DBrvuC
InChI InChI=1S/C20H26N4S2/c1-13(2)15-5-9-17(10-6-15)21-19(25)23-24-20(26)22-18-11-7-16(8-12-18)14(3)4/h5-14H,1-4H3,(H2,21,23,25)(H2,22,24,26)
InChIKey NJFXDPXVYBLYEW-UHFFFAOYSA-N
Mol Weight 386.58 g/mol
Molecular Formula C20H26N4S2
Exact Mass 386.159889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DMCAXtdF0Sk
Name 1,6-bis(p-Cumenyl)-2,5-dithiobiurea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.159889201 u
Formula C20H26N4S2
InChI InChI=1S/C20H26N4S2/c1-13(2)15-5-9-17(10-6-15)21-19(25)23-24-20(26)22-18-11-7-16(8-12-18)14(3)4/h5-14H,1-4H3,(H2,21,23,25)(H2,22,24,26)
InChIKey NJFXDPXVYBLYEW-UHFFFAOYSA-N
Molecular Weight 386.576 g/mol
SMILES N(C1=CC=C(C=C1)C(C)C)C(NNC(NC=1C=CC(=CC1)C(C)C)=S)=S