CID 24700711

N-(2-cyanophenyl)picolinamide

Structural Information

Molecular Formula
C13H9N3O
SMILES
C1=CC=C(C(=C1)C#N)NC(=O)C2=CC=CC=N2
InChI
InChI=1S/C13H9N3O/c14-9-10-5-1-2-6-11(10)16-13(17)12-7-3-4-8-15-12/h1-8H,(H,16,17)
InChIKey
CMOBXBANKIGTSJ-UHFFFAOYSA-N
Compound name
N-(2-cyanophenyl)pyridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

229
Patents

223.07455 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.08183 154.6
[M+Na]+ 246.06377 167.7
[M+NH4]+ 241.10837 159.1
[M+K]+ 262.03771 157.4
[M-H]- 222.06727 151.3
[M+Na-2H]- 244.04922 161.0
[M]+ 223.07400 154.7
[M]- 223.07510 154.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe