CID 170416

1,1,2,2-tetrafluoropropane (fc-254cb)

Structural Information

Molecular Formula
C3H4F4
SMILES
CC(C(F)F)(F)F
InChI
InChI=1S/C3H4F4/c1-3(6,7)2(4)5/h2H,1H3
InChIKey
XWUSALIIUZARQE-UHFFFAOYSA-N
Compound name
1,1,2,2-tetrafluoropropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10741
Patents

116.02491 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.03219 114.3
[M+Na]+ 139.01413 123.0
[M-H]- 115.01763 109.9
[M+NH4]+ 134.05873 136.8
[M+K]+ 154.98807 122.9
[M+H-H2O]+ 99.022170 107.5
[M+HCOO]- 161.02311 132.2
[M+CH3COO]- 175.03876 170.7
[M+Na-2H]- 136.99958 120.1
[M]+ 116.02436 108.2
[M]- 116.02546 108.2
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