CID 123516

2,2,3,3,3-pentafluoropropyl methacrylate

Structural Information

Molecular Formula
C7H7F5O2
SMILES
CC(=C)C(=O)OCC(C(F)(F)F)(F)F
InChI
InChI=1S/C7H7F5O2/c1-4(2)5(13)14-3-6(8,9)7(10,11)12/h1,3H2,2H3
InChIKey
CLISWDZSTWQFNX-UHFFFAOYSA-N
Compound name
2,2,3,3,3-pentafluoropropyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

3331
Patents

218.03662 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.04390 138.0
[M+Na]+ 241.02584 146.2
[M-H]- 217.02934 132.2
[M+NH4]+ 236.07044 156.3
[M+K]+ 256.99978 145.1
[M+H-H2O]+ 201.03388 130.1
[M+HCOO]- 263.03482 152.0
[M+CH3COO]- 277.05047 187.4
[M+Na-2H]- 239.01129 140.9
[M]+ 218.03607 132.2
[M]- 218.03717 132.2
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