CID 122980

Trichloromethyl free radical

Structural Information

Molecular Formula
CCl3
SMILES
[C](Cl)(Cl)Cl
InChI
InChI=1S/CCl3/c2-1(3)4
InChIKey
ZBZJXHCVGLJWFG-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

30
References

0
Patents

116.906555 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.913831 112.9
[M+Na]+ 139.895773 122.7
[M-H]- 115.899279 112.0
[M+NH4]+ 134.940378 136.2
[M+K]+ 155.869713 119.2
[M+H-H2O]+ 99.903815 112.0
[M+HCOO]- 161.904756 122.1
[M+CH3COO]- 175.920406 168.4
[M+Na-2H]- 137.881221 119.2
[M]+ 116.90600642 113.8
[M]- 116.90710358 113.8
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

No patent data available for this compound.