CID 67908

1,1,1-trichloro-2,2,3,3-tetrafluoropropane

Structural Information

Molecular Formula
C3HCl3F4
SMILES
C(C(C(Cl)(Cl)Cl)(F)F)(F)F
InChI
InChI=1S/C3HCl3F4/c4-3(5,6)2(9,10)1(7)8/h1H
InChIKey
LJPLFJPOUHWADA-UHFFFAOYSA-N
Compound name
1,1,1-trichloro-2,2,3,3-tetrafluoropropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

229
Patents

217.90799 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.91527 127.3
[M+Na]+ 240.89721 137.5
[M-H]- 216.90071 121.8
[M+NH4]+ 235.94181 146.9
[M+K]+ 256.87115 132.5
[M+H-H2O]+ 200.90525 123.0
[M+HCOO]- 262.90619 129.3
[M+CH3COO]- 276.92184 184.8
[M+Na-2H]- 238.88266 132.0
[M]+ 217.90744 123.7
[M]- 217.90854 123.7
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