CID 68170

Eicosane, 1,20-difluoro-

Structural Information

Molecular Formula
C20H40F2
SMILES
C(CCCCCCCCCCF)CCCCCCCCCF
InChI
InChI=1S/C20H40F2/c21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22/h1-20H2
InChIKey
XZZDGJVIQBCSCZ-UHFFFAOYSA-N
Compound name
1,20-difluoroicosane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.3098 Da
Monoisotopic Mass

9.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.31708 187.5
[M+Na]+ 341.29902 188.9
[M-H]- 317.30252 182.2
[M+NH4]+ 336.34362 202.1
[M+K]+ 357.27296 184.2
[M+H-H2O]+ 301.30706 178.5
[M+HCOO]- 363.30800 204.5
[M+CH3COO]- 377.32365 215.0
[M+Na-2H]- 339.28447 185.8
[M]+ 318.30925 191.7
[M]- 318.31035 191.7
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.