CID 44717649

1h,1h,2h,2h,3h,3h,4h,4h,5h,5h-perfluoroundecyl acrylate

Structural Information

Molecular Formula
C14H13F13O2
SMILES
C=CC(=O)OCCCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C14H13F13O2/c1-2-8(28)29-7-5-3-4-6-9(15,16)10(17,18)11(19,20)12(21,22)13(23,24)14(25,26)27/h2H,1,3-7H2
InChIKey
WTZIOPYUTZFTHJ-UHFFFAOYSA-N
Compound name
6,6,7,7,8,8,9,9,10,10,11,11,11-tridecafluoroundecyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

460.0708 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 461.07808 169.4
[M+Na]+ 483.06002 176.6
[M-H]- 459.06352 173.0
[M+NH4]+ 478.10462 178.2
[M+K]+ 499.03396 181.7
[M+H-H2O]+ 443.06806 161.9
[M+HCOO]- 505.06900 188.3
[M+CH3COO]- 519.08465 231.6
[M+Na-2H]- 481.04547 167.0
[M]+ 460.07025 168.3
[M]- 460.07135 168.3
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

No patent data available for this compound.