CID 3016471

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

Structural Information

Molecular Formula
C15H7F21O2
SMILES
CC(=C)C(=O)OCC(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C15H7F21O2/c1-4(2)5(37)38-3-6(16,17)7(18,19)8(20,21)9(22,23)10(24,25)11(26,27)12(28,29)13(30,31)14(32,33)15(34,35)36/h1,3H2,2H3
InChIKey
QDIWIWGKFGVURE-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-henicosafluoroundecyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

30
Patents

618.01105 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 619.01833 191.4
[M+Na]+ 641.00027 196.7
[M-H]- 617.00377 202.7
[M+NH4]+ 636.04487 205.1
[M+K]+ 656.97421 208.8
[M+H-H2O]+ 601.00831 180.0
[M+HCOO]- 663.00925 207.5
[M+CH3COO]- 677.02490 254.3
[M+Na-2H]- 638.98572 191.3
[M]+ 618.01050 190.0
[M]- 618.01160 190.0
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