CID 69647

1,1,3,3,3-pentafluoropropene

Structural Information

Molecular Formula
C3HF5
SMILES
C(=C(F)F)C(F)(F)F
InChI
InChI=1S/C3HF5/c4-2(5)1-3(6,7)8/h1H
InChIKey
QAERDLQYXMEHEB-UHFFFAOYSA-N
Compound name
1,1,3,3,3-pentafluoroprop-1-ene
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

1
References

6263
Patents

131.99985 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.00713 115.6
[M+Na]+ 154.98907 124.9
[M-H]- 130.99257 110.1
[M+NH4]+ 150.03367 137.5
[M+K]+ 170.96301 123.8
[M+H-H2O]+ 114.99711 108.0
[M+HCOO]- 176.99805 132.7
[M+CH3COO]- 191.01370 171.4
[M+Na-2H]- 152.97452 120.9
[M]+ 131.99930 107.4
[M]- 132.00040 107.4
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