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

10585
Patents

116.02491 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.032186 114.3
[M+Na]+ 139.014128 123.0
[M-H]- 115.017634 109.9
[M+NH4]+ 134.058733 136.8
[M+K]+ 154.988068 122.9
[M+H-H2O]+ 99.022170 107.5
[M+HCOO]- 161.023111 132.2
[M+CH3COO]- 175.038761 170.7
[M+Na-2H]- 136.999576 120.1
[M]+ 116.02436142 108.2
[M]- 116.02545858 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