CID 3853245

1,1,2,2,3,3,4-heptafluorocyclopentane

Structural Information

Molecular Formula
C5H3F7
SMILES
C1C(C(C(C1(F)F)(F)F)(F)F)F
InChI
InChI=1S/C5H3F7/c6-2-1-3(7,8)5(11,12)4(2,9)10/h2H,1H2
InChIKey
IDBYQQQHBYGLEQ-UHFFFAOYSA-N
Compound name
1,1,2,2,3,3,4-heptafluorocyclopentane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

3454
Patents

196.0123 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.01958 162.5
[M+Na]+ 219.00152 166.2
[M+NH4]+ 214.04612 167.0
[M+K]+ 234.97546 159.7
[M-H]- 195.00502 156.1
[M+Na-2H]- 216.98697 163.7
[M]+ 196.01175 161.0
[M]- 196.01285 161.0
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