CID 155819769

2470436-14-5

Structural Information

Molecular Formula
C5HCl3FNO2S
SMILES
C1=C(C(=C(N=C1Cl)Cl)F)S(=O)(=O)Cl
InChI
InChI=1S/C5HCl3FNO2S/c6-3-1-2(13(8,11)12)4(9)5(7)10-3/h1H
InChIKey
VACYSIAJRUUKSM-UHFFFAOYSA-N
Compound name
2,6-dichloro-3-fluoropyridine-4-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.87775 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.88503 139.3
[M+Na]+ 285.86697 152.1
[M-H]- 261.87047 140.5
[M+NH4]+ 280.91157 157.0
[M+K]+ 301.84091 146.5
[M+H-H2O]+ 245.87501 135.7
[M+HCOO]- 307.87595 141.7
[M+CH3COO]- 321.89160 188.7
[M+Na-2H]- 283.85242 142.2
[M]+ 262.87720 143.7
[M]- 262.87830 143.7
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.