CID 15985041

Bis(2,2-difluoroethyl) carbonate

Structural Information

Molecular Formula
C5H6F4O3
SMILES
C(C(F)F)OC(=O)OCC(F)F
InChI
InChI=1S/C5H6F4O3/c6-3(7)1-11-5(10)12-2-4(8)9/h3-4H,1-2H2
InChIKey
UYFISINJOLGYBJ-UHFFFAOYSA-N
Compound name
bis(2,2-difluoroethyl) carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1476
Patents

190.0253 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.03258 132.3
[M+Na]+ 213.01452 139.7
[M-H]- 189.01802 127.4
[M+NH4]+ 208.05912 151.5
[M+K]+ 228.98846 140.3
[M+H-H2O]+ 173.02256 124.0
[M+HCOO]- 235.02350 150.1
[M+CH3COO]- 249.03915 181.6
[M+Na-2H]- 210.99997 133.8
[M]+ 190.02475 129.8
[M]- 190.02585 129.8
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