CID 69937

1,1,2-trichloro-1-fluoroethane

Structural Information

Molecular Formula
C2H2Cl3F
SMILES
C(C(F)(Cl)Cl)Cl
InChI
InChI=1S/C2H2Cl3F/c3-1-2(4,5)6/h1H2
InChIKey
ZKVMMSGRDBQIOQ-UHFFFAOYSA-N
Compound name
1,1,2-trichloro-1-fluoroethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1855
Patents

149.92061 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.92789 119.9
[M+Na]+ 172.90983 130.0
[M-H]- 148.91333 117.8
[M+NH4]+ 167.95443 142.1
[M+K]+ 188.88377 125.8
[M+H-H2O]+ 132.91787 118.0
[M+HCOO]- 194.91881 127.2
[M+CH3COO]- 208.93446 173.4
[M+Na-2H]- 170.89528 126.8
[M]+ 149.92006 120.2
[M]- 149.92116 120.2
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