CID 55279488

5-chloro-2-methoxypyridine-3-sulfonyl chloride

Structural Information

Molecular Formula
C6H5Cl2NO3S
SMILES
COC1=C(C=C(C=N1)Cl)S(=O)(=O)Cl
InChI
InChI=1S/C6H5Cl2NO3S/c1-12-6-5(13(8,10)11)2-4(7)3-9-6/h2-3H,1H3
InChIKey
NXSVBFKTYWUUHZ-UHFFFAOYSA-N
Compound name
5-chloro-2-methoxypyridine-3-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

94
Patents

240.93672 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.94400 146.7
[M+Na]+ 263.92594 160.5
[M+NH4]+ 258.97054 154.5
[M+K]+ 279.89988 152.6
[M-H]- 239.92944 146.8
[M+Na-2H]- 261.91139 152.3
[M]+ 240.93617 149.7
[M]- 240.93727 149.7
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

patents stripe