CID 11275251

7-chlorothieno[3,2-b]pyridine

Structural Information

Molecular Formula
C7H4ClNS
SMILES
C1=CN=C2C=CSC2=C1Cl
InChI
InChI=1S/C7H4ClNS/c8-5-1-3-9-6-2-4-10-7(5)6/h1-4H
InChIKey
GYQUXKQLCNFKQT-UHFFFAOYSA-N
Compound name
7-chlorothieno[3,2-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

545
Patents

168.9753 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.982576 127.4
[M+Na]+ 191.964518 140.6
[M-H]- 167.968024 132.0
[M+NH4]+ 187.009123 151.5
[M+K]+ 207.938458 136.0
[M+H-H2O]+ 151.972560 123.0
[M+HCOO]- 213.973501 143.8
[M+CH3COO]- 227.989151 143.0
[M+Na-2H]- 189.949966 133.6
[M]+ 168.97475142 132.8
[M]- 168.97584858 132.8
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