CID 9859

1,16-difluorohexadecane

Structural Information

Molecular Formula
C16H32F2
SMILES
C(CCCCCCCCF)CCCCCCCF
InChI
InChI=1S/C16H32F2/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18/h1-16H2
InChIKey
ZFLGLTJLVNUUIO-UHFFFAOYSA-N
Compound name
1,16-difluorohexadecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

262.2472 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.25448 169.5
[M+Na]+ 285.23642 172.6
[M-H]- 261.23992 165.0
[M+NH4]+ 280.28102 186.4
[M+K]+ 301.21036 169.0
[M+H-H2O]+ 245.24446 161.3
[M+HCOO]- 307.24540 187.8
[M+CH3COO]- 321.26105 203.1
[M+Na-2H]- 283.22187 170.0
[M]+ 262.24665 172.2
[M]- 262.24775 172.2
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