CID 102464

1-chloro-1,2,2,3,3-pentafluoropropane

Structural Information

Molecular Formula
C3H2ClF5
SMILES
C(C(C(F)Cl)(F)F)(F)F
InChI
InChI=1S/C3H2ClF5/c4-1(5)3(8,9)2(6)7/h1-2H
InChIKey
FXSNEEBOGAOVIM-UHFFFAOYSA-N
Compound name
1-chloro-1,2,2,3,3-pentafluoropropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

584
Patents

167.97652 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.98380 119.9
[M+Na]+ 190.96574 129.3
[M-H]- 166.96924 114.2
[M+NH4]+ 186.01034 141.0
[M+K]+ 206.93968 126.8
[M+H-H2O]+ 150.97378 113.0
[M+HCOO]- 212.97472 131.4
[M+CH3COO]- 226.99037 178.4
[M+Na-2H]- 188.95119 123.7
[M]+ 167.97597 113.8
[M]- 167.97707 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

No literature data available for this compound.

Patent stripe

patents stripe