CID 67739

1h,1h,5h-octafluoropentyl methacrylate

Structural Information

Molecular Formula
C9H8F8O2
SMILES
CC(=C)C(=O)OCC(C(C(C(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C9H8F8O2/c1-4(2)5(18)19-3-7(12,13)9(16,17)8(14,15)6(10)11/h6H,1,3H2,2H3
InChIKey
ZNJXRXXJPIFFAO-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5-octafluoropentyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

4610
Patents

300.03964 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.04692 153.7
[M+Na]+ 323.02886 161.4
[M-H]- 299.03236 144.1
[M+NH4]+ 318.07346 168.2
[M+K]+ 339.00280 159.5
[M+H-H2O]+ 283.03690 143.4
[M+HCOO]- 345.03784 161.4
[M+CH3COO]- 359.05349 204.1
[M+Na-2H]- 321.01431 153.8
[M]+ 300.03909 143.3
[M]- 300.04019 143.3
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