CID 11116473

6-(2-furyl)nicotinonitrile

Structural Information

Molecular Formula
C10H6N2O
SMILES
C1=COC(=C1)C2=NC=C(C=C2)C#N
InChI
InChI=1S/C10H6N2O/c11-6-8-3-4-9(12-7-8)10-2-1-5-13-10/h1-5,7H
InChIKey
MLVPTQAKBGAZLS-UHFFFAOYSA-N
Compound name
6-(furan-2-yl)pyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

16
Patents

170.04802 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.05530 137.1
[M+Na]+ 193.03724 150.9
[M+NH4]+ 188.08184 142.6
[M+K]+ 209.01118 142.7
[M-H]- 169.04074 134.3
[M+Na-2H]- 191.02269 143.1
[M]+ 170.04747 137.6
[M]- 170.04857 137.6
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