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2,3,5,6-Tetra-m-tolylpyrazine

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

2,3,5,6-Tetra-m-tolylpyrazine
SpectraBase Compound ID Bc8isCDGEfv
InChI InChI=1S/C32H28N2/c1-21-9-5-13-25(17-21)29-30(26-14-6-10-22(2)18-26)34-32(28-16-8-12-24(4)20-28)31(33-29)27-15-7-11-23(3)19-27/h5-20H,1-4H3
InChIKey SJIFLMFPGABURT-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C32H28N2
Exact Mass 440.225249 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4IMWCZ4BiM1
Name 2,3,5,6-Tetra-m-tolylpyrazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 440.225248910 u
Formula C32H28N2
InChI InChI=1S/C32H28N2/c1-21-9-5-13-25(17-21)29-30(26-14-6-10-22(2)18-26)34-32(28-16-8-12-24(4)20-28)31(33-29)27-15-7-11-23(3)19-27/h5-20H,1-4H3
InChIKey SJIFLMFPGABURT-UHFFFAOYSA-N
Molecular Weight 440.590 g/mol
SMILES C1(C=2C=C(C=CC2)C)=C(C=2C=CC=C(C2)C)N=C(C=2C=C(C=CC2)C)C(C=2C=CC=C(C2)C)=N1