CID 678565

2-methoxy-4,6-diphenylpyridine-3-carbonitrile

Structural Information

Molecular Formula
C19H14N2O
SMILES
COC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N
InChI
InChI=1S/C19H14N2O/c1-22-19-17(13-20)16(14-8-4-2-5-9-14)12-18(21-19)15-10-6-3-7-11-15/h2-12H,1H3
InChIKey
AZCJARWALWIYCW-UHFFFAOYSA-N
Compound name
2-methoxy-4,6-diphenylpyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

3
Patents

286.11063 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.11791 171.0
[M+Na]+ 309.09985 181.7
[M-H]- 285.10335 177.0
[M+NH4]+ 304.14445 183.1
[M+K]+ 325.07379 173.7
[M+H-H2O]+ 269.10789 154.7
[M+HCOO]- 331.10883 189.6
[M+CH3COO]- 345.12448 180.8
[M+Na-2H]- 307.08530 175.3
[M]+ 286.11008 166.2
[M]- 286.11118 166.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.