CID 84925

15453-08-4

Structural Information

Molecular Formula
C5F8O
SMILES
C(=C(F)F)(C(C1(C(O1)(F)F)F)(F)F)F
InChI
InChI=1S/C5F8O/c6-1(2(7)8)3(9,10)4(11)5(12,13)14-4
InChIKey
ZHOFEJCLMUIOIW-UHFFFAOYSA-N
Compound name
2,2,3-trifluoro-3-(1,1,2,3,3-pentafluoroprop-2-enyl)oxirane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

8
Patents

227.98215 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.98943 123.1
[M+Na]+ 250.97137 134.8
[M-H]- 226.97487 119.5
[M+NH4]+ 246.01597 138.4
[M+K]+ 266.94531 134.3
[M+H-H2O]+ 210.97941 113.6
[M+HCOO]- 272.98035 134.5
[M+CH3COO]- 286.99600 191.5
[M+Na-2H]- 248.95682 128.5
[M]+ 227.98160 116.1
[M]- 227.98270 116.1
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