CID 3017673

1,1,2,2,3,3,4,4-octafluoro-5-(vinyloxy)pentane

Structural Information

Molecular Formula
C7H6F8O
SMILES
C=COCC(C(C(C(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C7H6F8O/c1-2-16-3-5(10,11)7(14,15)6(12,13)4(8)9/h2,4H,1,3H2
InChIKey
LIXQMBUPLJAAOE-UHFFFAOYSA-N
Compound name
5-ethenoxy-1,1,2,2,3,3,4,4-octafluoropentane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

179
Patents

258.02908 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.03636 145.2
[M+Na]+ 281.01830 153.6
[M-H]- 257.02180 135.6
[M+NH4]+ 276.06290 161.4
[M+K]+ 296.99224 151.4
[M+H-H2O]+ 241.02634 134.8
[M+HCOO]- 303.02728 154.8
[M+CH3COO]- 317.04293 196.5
[M+Na-2H]- 279.00375 148.1
[M]+ 258.02853 134.5
[M]- 258.02963 134.5
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