CID 2775839

Nonafluoropentanoyl bromide

Structural Information

Molecular Formula
C5BrF9O
SMILES
C(=O)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)Br
InChI
InChI=1S/C5BrF9O/c6-1(16)2(7,8)3(9,10)4(11,12)5(13,14)15
InChIKey
CJRZVDYMJZXUDK-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5,5-nonafluoropentanoyl bromide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

325.89886 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.90614 162.5
[M+Na]+ 348.88808 175.3
[M-H]- 324.89158 155.7
[M+NH4]+ 343.93268 179.5
[M+K]+ 364.86202 163.8
[M+H-H2O]+ 308.89612 157.3
[M+HCOO]- 370.89706 168.5
[M+CH3COO]- 384.91271 202.5
[M+Na-2H]- 346.87353 166.4
[M]+ 325.89831 166.9
[M]- 325.89941 166.9
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