CID 2776195

65195-44-0

Structural Information

Molecular Formula
C11H9F11O2
SMILES
CC(=C)C(=O)OCCC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F
InChI
InChI=1S/C11H9F11O2/c1-5(2)6(23)24-4-3-7(12,13)9(15,16)8(14,10(17,18)19)11(20,21)22/h1,3-4H2,2H3
InChIKey
JTEKNLSWXJADLG-UHFFFAOYSA-N
Compound name
[3,3,4,4,5,6,6,6-octafluoro-5-(trifluoromethyl)hexyl] 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

243
Patents

382.0427 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.04998 190.4
[M+Na]+ 405.03192 190.2
[M+NH4]+ 400.07652 189.0
[M+K]+ 421.00586 188.2
[M-H]- 381.03542 183.5
[M+Na-2H]- 403.01737 187.0
[M]+ 382.04215 188.1
[M]- 382.04325 188.1
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