CID 10420

Fluoroacetonitrile

Structural Information

Molecular Formula
C2H2FN
SMILES
C(C#N)F
InChI
InChI=1S/C2H2FN/c3-1-2-4/h1H2
InChIKey
GNFVFPBRMLIKIM-UHFFFAOYSA-N
Compound name
2-fluoroacetonitrile
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

1547
Patents

59.017128 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 60.024404 101.5
[M+Na]+ 82.006346 112.0
[M-H]- 58.009852 101.8
[M+NH4]+ 77.050951 124.1
[M+K]+ 97.980286 112.3
[M+H-H2O]+ 42.014388 90.7
[M+HCOO]- 104.01533 122.2
[M+CH3COO]- 118.03098 173.7
[M+Na-2H]- 79.991794 110.4
[M]+ 59.016579 95.5
[M]- 59.017677 95.5
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