CID 22420417

51502-43-3

Structural Information

Molecular Formula
C7H3F11O3
SMILES
COC(=O)C(C(OC(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F
InChI
InChI=1S/C7H3F11O3/c1-20-2(19)3(8,9)7(17,18)21-4(10,5(11,12)13)6(14,15)16/h1H3
InChIKey
ZIBMBDGKVCYGHR-UHFFFAOYSA-N
Compound name
methyl 2,2,3,3-tetrafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.99066 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.99794 186.4
[M+Na]+ 366.97988 186.3
[M+NH4]+ 362.02448 185.1
[M+K]+ 382.95382 184.6
[M-H]- 342.98338 179.5
[M+Na-2H]- 364.96533 183.3
[M]+ 343.99011 184.1
[M]- 343.99121 184.1
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

No patent data available for this compound.