CID 2775840

Nonafluoropentanoyl chloride

Structural Information

Molecular Formula
C5ClF9O
SMILES
C(=O)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)Cl
InChI
InChI=1S/C5ClF9O/c6-1(16)2(7,8)3(9,10)4(11,12)5(13,14)15
InChIKey
HRBNMYUNLLWPAX-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5,5-nonafluoropentanoyl chloride
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

127
Patents

281.9494 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.95668 184.0
[M+Na]+ 304.93862 185.0
[M+NH4]+ 299.98322 183.6
[M+K]+ 320.91256 182.4
[M-H]- 280.94212 175.7
[M+Na-2H]- 302.92407 180.9
[M]+ 281.94885 181.5
[M]- 281.94995 181.5
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