CID 15586

1,1-dichloro-1-fluoroethane

Structural Information

Molecular Formula
C2H3Cl2F
SMILES
CC(F)(Cl)Cl
InChI
InChI=1S/C2H3Cl2F/c1-2(3,4)5/h1H3
InChIKey
FRCHKSNAZZFGCA-UHFFFAOYSA-N
Compound name
1,1-dichloro-1-fluoroethane
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

31
References

20051
Patents

115.95959 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.96687 113.1
[M+Na]+ 138.94881 123.5
[M-H]- 114.95231 112.2
[M+NH4]+ 133.99341 137.0
[M+K]+ 154.92275 120.4
[M+H-H2O]+ 98.956850 110.8
[M+HCOO]- 160.95779 125.9
[M+CH3COO]- 174.97344 167.4
[M+Na-2H]- 136.93426 121.3
[M]+ 115.95904 113.6
[M]- 115.96014 113.6
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