CID 2775875

2,2,3,3,4,4,5,5-octafluoropentanoyl chloride

Structural Information

Molecular Formula
C5HClF8O
SMILES
C(C(C(C(C(=O)Cl)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C5HClF8O/c6-1(15)3(9,10)5(13,14)4(11,12)2(7)8/h2H
InChIKey
GMTHNTFUIUGECX-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5-octafluoropentanoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

263.95883 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.96611 136.6
[M+Na]+ 286.94805 146.5
[M-H]- 262.95155 127.6
[M+NH4]+ 281.99265 153.5
[M+K]+ 302.92199 143.0
[M+H-H2O]+ 246.95609 127.6
[M+HCOO]- 308.95703 141.9
[M+CH3COO]- 322.97268 195.1
[M+Na-2H]- 284.93350 139.5
[M]+ 263.95828 126.8
[M]- 263.95938 126.8
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