CID 12415568

5-chlorothieno[3,2-b]pyridine

Structural Information

Molecular Formula
C7H4ClNS
SMILES
C1=CC(=NC2=C1SC=C2)Cl
InChI
InChI=1S/C7H4ClNS/c8-7-2-1-6-5(9-7)3-4-10-6/h1-4H
InChIKey
DINNLDMXTNAIQE-UHFFFAOYSA-N
Compound name
5-chlorothieno[3,2-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

182
Patents

168.9753 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.98258 128.1
[M+Na]+ 191.96452 143.8
[M+NH4]+ 187.00912 139.5
[M+K]+ 207.93846 135.1
[M-H]- 167.96802 131.5
[M+Na-2H]- 189.94997 136.3
[M]+ 168.97475 132.2
[M]- 168.97585 132.2
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