CID 94258

Heptafluoropropyl 1,2,2,2-tetrafluoroethyl ether

Structural Information

Molecular Formula
C5HF11O
SMILES
C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F
InChI
InChI=1S/C5HF11O/c6-1(2(7,8)9)17-5(15,16)3(10,11)4(12,13)14/h1H
InChIKey
CUTPKDUMZWIJKT-UHFFFAOYSA-N
Compound name
1,1,1,2,2,3,3-heptafluoro-3-(1,2,2,2-tetrafluoroethoxy)propane
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

413
Patents

285.98517 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.99245 146.6
[M+Na]+ 308.97439 156.2
[M-H]- 284.97789 134.3
[M+NH4]+ 304.01899 161.4
[M+K]+ 324.94833 154.3
[M+H-H2O]+ 268.98243 134.4
[M+HCOO]- 330.98337 152.0
[M+CH3COO]- 344.99902 200.1
[M+Na-2H]- 306.95984 149.5
[M]+ 285.98462 130.6
[M]- 285.98572 130.6
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