CID 3084815

2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-icosafluoroundecyl methacrylate

Structural Information

Molecular Formula
C15H8F20O2
SMILES
CC(=C)C(=O)OC(C(C(C(C(C(C(C(C(C(CF)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F
InChI
InChI=1S/C15H8F20O2/c1-4(2)5(36)37-6(17)8(20,21)10(24,25)12(28,29)14(32,33)15(34,35)13(30,31)11(26,27)9(22,23)7(18,19)3-16/h6H,1,3H2,2H3
InChIKey
KDUYSMPJTYKVBA-UHFFFAOYSA-N
Compound name
1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11-icosafluoroundecyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

10
Patents

600.0205 Da
Monoisotopic Mass

8.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 601.02778 190.6
[M+Na]+ 623.00972 196.7
[M-H]- 599.01322 201.5
[M+NH4]+ 618.05432 204.7
[M+K]+ 638.98366 208.2
[M+H-H2O]+ 583.01776 180.6
[M+HCOO]- 645.01870 204.6
[M+CH3COO]- 659.03435 253.1
[M+Na-2H]- 620.99517 190.3
[M]+ 600.01995 188.5
[M]- 600.02105 188.5
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