CID 57762393

4-chloro-3-methylthieno[3,2-c]pyridine

Structural Information

Molecular Formula
C8H6ClNS
SMILES
CC1=CSC2=C1C(=NC=C2)Cl
InChI
InChI=1S/C8H6ClNS/c1-5-4-11-6-2-3-10-8(9)7(5)6/h2-4H,1H3
InChIKey
MVVRTBBYAOXPCY-UHFFFAOYSA-N
Compound name
4-chloro-3-methylthieno[3,2-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

182.99095 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.99823 132.8
[M+Na]+ 205.98017 148.7
[M+NH4]+ 201.02477 144.0
[M+K]+ 221.95411 139.9
[M-H]- 181.98367 136.2
[M+Na-2H]- 203.96562 140.5
[M]+ 182.99040 137.0
[M]- 182.99150 137.0
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