CID 9920419

N-(pyridin-2-yl)prop-2-enamide

Structural Information

Molecular Formula
C8H8N2O
SMILES
C=CC(=O)NC1=CC=CC=N1
InChI
InChI=1S/C8H8N2O/c1-2-8(11)10-7-5-3-4-6-9-7/h2-6H,1H2,(H,9,10,11)
InChIKey
ZUKUBTGXSHTDHA-UHFFFAOYSA-N
Compound name
N-pyridin-2-ylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

174
Patents

148.06366 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.07094 130.3
[M+Na]+ 171.05288 142.3
[M+NH4]+ 166.09748 138.1
[M+K]+ 187.02682 136.2
[M-H]- 147.05638 131.9
[M+Na-2H]- 169.03833 137.5
[M]+ 148.06311 132.2
[M]- 148.06421 132.2
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