CID 456701

N-(benzylideneamino)pyridine-4-carboxamide

Structural Information

Molecular Formula
C13H11N3O
SMILES
C1=CC=C(C=C1)C=NNC(=O)C2=CC=NC=C2
InChI
InChI=1S/C13H11N3O/c17-13(12-6-8-14-9-7-12)16-15-10-11-4-2-1-3-5-11/h1-10H,(H,16,17)
InChIKey
UFMAHOLDSCSFMC-UHFFFAOYSA-N
Compound name
N-(benzylideneamino)pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

225.09021 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.09749 150.4
[M+Na]+ 248.07943 163.6
[M+NH4]+ 243.12403 158.4
[M+K]+ 264.05337 155.9
[M-H]- 224.08293 155.4
[M+Na-2H]- 246.06488 160.8
[M]+ 225.08966 153.5
[M]- 225.09076 153.5
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