CID 118833170

4-fluoro-3-methylpicolinonitrile

Structural Information

Molecular Formula
C7H5FN2
SMILES
CC1=C(C=CN=C1C#N)F
InChI
InChI=1S/C7H5FN2/c1-5-6(8)2-3-10-7(5)4-9/h2-3H,1H3
InChIKey
NKHZJVSRTBTXIQ-UHFFFAOYSA-N
Compound name
4-fluoro-3-methylpyridine-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

136.04367 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.05095 127.1
[M+Na]+ 159.03289 140.2
[M+NH4]+ 154.07749 132.1
[M+K]+ 175.00683 130.5
[M-H]- 135.03639 120.6
[M+Na-2H]- 157.01834 131.8
[M]+ 136.04312 126.3
[M]- 136.04422 126.3
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.