CID 6391

Dichlorodifluoromethane

Structural Information

Molecular Formula
CCl2F2
SMILES
C(F)(F)(Cl)Cl
InChI
InChI=1S/CCl2F2/c2-1(3,4)5
InChIKey
PXBRQCKWGAHEHS-UHFFFAOYSA-N
Compound name
dichloro(difluoro)methane
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

85
References

7337
Patents

119.93451 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 120.941786 109.9
[M+Na]+ 142.923728 120.7
[M-H]- 118.927234 107.8
[M+NH4]+ 137.968333 133.6
[M+K]+ 158.897668 117.5
[M+H-H2O]+ 102.931770 106.9
[M+HCOO]- 164.932711 122.1
[M+CH3COO]- 178.948361 167.1
[M+Na-2H]- 140.909176 118.1
[M]+ 119.93396142 109.0
[M]- 119.93505858 109.0
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