CID 79004

1,2-dichloro-1-fluoroethane

Structural Information

Molecular Formula
C2H3Cl2F
SMILES
C(C(F)Cl)Cl
InChI
InChI=1S/C2H3Cl2F/c3-1-2(4)5/h2H,1H2
InChIKey
NDKGUMMLYBINOC-UHFFFAOYSA-N
Compound name
1,2-dichloro-1-fluoroethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3415
Patents

115.95959 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.966866 112.6
[M+Na]+ 138.948808 122.3
[M-H]- 114.952314 111.4
[M+NH4]+ 133.993413 136.3
[M+K]+ 154.922748 119.3
[M+H-H2O]+ 98.956850 110.0
[M+HCOO]- 160.957791 126.0
[M+CH3COO]- 174.973441 167.9
[M+Na-2H]- 136.934256 119.1
[M]+ 115.95904142 113.1
[M]- 115.96013858 113.1
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