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4-Amino-5-cyano-2,6-diphenylpyrimidine, tms

View entire compound with spectra: 1 NMR

4-Amino-5-cyano-2,6-diphenylpyrimidine, tms
SpectraBase Compound ID IS82C4oTgCI
InChI InChI=1S/C20H20N4Si/c1-25(2,3)24-20-17(14-21)18(15-10-6-4-7-11-15)22-19(23-20)16-12-8-5-9-13-16/h4-13H,1-3H3,(H,22,23,24)
InChIKey NZMXAZAVQXPQNO-UHFFFAOYSA-N
Mol Weight 344.49 g/mol
Molecular Formula C20H20N4Si
Exact Mass 344.145723 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BbHXDkogOAL
Name 4-Amino-5-cyano-2,6-diphenylpyrimidine, tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.145723195 u
Formula C20H20N4Si
InChI InChI=1S/C20H20N4Si/c1-25(2,3)24-20-17(14-21)18(15-10-6-4-7-11-15)22-19(23-20)16-12-8-5-9-13-16/h4-13H,1-3H3,(H,22,23,24)
InChIKey NZMXAZAVQXPQNO-UHFFFAOYSA-N
Molecular Weight 344.493 g/mol
SMILES C1(N[Si](C)(C)C)=NC(=NC(=C1C#N)C1=CC=CC=C1)C1=CC=CC=C1