CID 23089516

2-(pentafluoroethyl)oxirane

Structural Information

Molecular Formula
C4H3F5O
SMILES
C1C(O1)C(C(F)(F)F)(F)F
InChI
InChI=1S/C4H3F5O/c5-3(6,2-1-10-2)4(7,8)9/h2H,1H2
InChIKey
VQWGFENTQFTYAN-UHFFFAOYSA-N
Compound name
2-(1,1,2,2,2-pentafluoroethyl)oxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

162.0104 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.017676 117.1
[M+Na]+ 184.999618 127.7
[M-H]- 161.003124 116.6
[M+NH4]+ 180.044223 131.7
[M+K]+ 200.973558 127.1
[M+H-H2O]+ 145.007660 107.9
[M+HCOO]- 207.008601 132.9
[M+CH3COO]- 221.024251 179.3
[M+Na-2H]- 182.985066 125.7
[M]+ 162.00985142 113.6
[M]- 162.01094858 113.6
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