CID 67829

1h,1h,5h-octafluoropentyl acrylate

Structural Information

Molecular Formula
C8H6F8O2
SMILES
C=CC(=O)OCC(C(C(C(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C8H6F8O2/c1-2-4(17)18-3-6(11,12)8(15,16)7(13,14)5(9)10/h2,5H,1,3H2
InChIKey
WISUNKZXQSKYMR-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5-octafluoropentyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

1564
Patents

286.02402 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.03130 150.3
[M+Na]+ 309.01324 158.5
[M-H]- 285.01674 140.7
[M+NH4]+ 304.05784 165.4
[M+K]+ 324.98718 156.4
[M+H-H2O]+ 269.02128 139.9
[M+HCOO]- 331.02222 159.2
[M+CH3COO]- 345.03787 200.4
[M+Na-2H]- 306.99869 151.9
[M]+ 286.02347 140.1
[M]- 286.02457 140.1
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