CID 134921

Fx 80

Structural Information

Molecular Formula
C8H7F9O
SMILES
C1CC(OC1)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C8H7F9O/c9-5(10,4-2-1-3-18-4)6(11,12)7(13,14)8(15,16)17/h4H,1-3H2
InChIKey
CJFUEPJVIFJOOU-UHFFFAOYSA-N
Compound name
2-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)oxolane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

12
References

1670
Patents

290.0353 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.042576 151.3
[M+Na]+ 313.024518 159.1
[M-H]- 289.028024 144.1
[M+NH4]+ 308.069123 166.5
[M+K]+ 328.998458 157.6
[M+H-H2O]+ 273.032560 140.4
[M+HCOO]- 335.033501 157.4
[M+CH3COO]- 349.049151 198.7
[M+Na-2H]- 311.009966 155.2
[M]+ 290.03475142 136.5
[M]- 290.03584858 136.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe