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2-Tert-butyl-1-cyclohexyl-4,6,6-triphenyl-1,3,5-triazahexa-1,3,5-triene

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

2-Tert-butyl-1-cyclohexyl-4,6,6-triphenyl-1,3,5-triazahexa-1,3,5-triene
SpectraBase Compound ID LUQGR7MHvSh
InChI InChI=1S/C31H35N3/c1-31(2,3)30(32-27-22-14-7-15-23-27)34-29(26-20-12-6-13-21-26)33-28(24-16-8-4-9-17-24)25-18-10-5-11-19-25/h4-6,8-13,16-21,27H,7,14-15,22-23H2,1-3H3/b32-30+,34-29+
InChIKey QBBJFXVDYSOVRV-DAHHPKAFSA-N
Mol Weight 449.6 g/mol
Molecular Formula C31H35N3
Exact Mass 449.283098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CsBQbAfeWq4
Name 2-Tert-butyl-1-cyclohexyl-4,6,6-triphenyl-1,3,5-triazahexa-1,3,5-triene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 449.283098139 u
Formula C31H35N3
InChI InChI=1S/C31H35N3/c1-31(2,3)30(32-27-22-14-7-15-23-27)34-29(26-20-12-6-13-21-26)33-28(24-16-8-4-9-17-24)25-18-10-5-11-19-25/h4-6,8-13,16-21,27H,7,14-15,22-23H2,1-3H3/b32-30+,34-29+
InChIKey QBBJFXVDYSOVRV-DAHHPKAFSA-N
Molecular Weight 449.642 g/mol
SMILES C(=N\C(=N\C(=N\C1CCCCC1)C(C)(C)C)C1=CC=CC=C1)(C1=CC=CC=C1)C=1C=CC=CC1