CID 22017299

5-chlorothieno[3,2-b]pyridine-2-sulfonyl chloride

Structural Information

Molecular Formula
C7H3Cl2NO2S2
SMILES
C1=CC(=NC2=C1SC(=C2)S(=O)(=O)Cl)Cl
InChI
InChI=1S/C7H3Cl2NO2S2/c8-6-2-1-5-4(10-6)3-7(13-5)14(9,11)12/h1-3H
InChIKey
DDOAASFFFGZAFG-UHFFFAOYSA-N
Compound name
5-chlorothieno[3,2-b]pyridine-2-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

266.89822 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.90550 155.4
[M+Na]+ 289.88744 169.6
[M+NH4]+ 284.93204 164.7
[M+K]+ 305.86138 160.2
[M-H]- 265.89094 156.6
[M+Na-2H]- 287.87289 160.4
[M]+ 266.89767 159.3
[M]- 266.89877 159.3
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