CID 12558370

1-methyl-1h-imidazo[4,5-c]pyridine-2-thiol

Structural Information

Molecular Formula
C7H7N3S
SMILES
CN1C2=C(C=NC=C2)NC1=S
InChI
InChI=1S/C7H7N3S/c1-10-6-2-3-8-4-5(6)9-7(10)11/h2-4H,1H3,(H,9,11)
InChIKey
GCYONDMJGUUSSV-UHFFFAOYSA-N
Compound name
1-methyl-3H-imidazo[4,5-c]pyridine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

165.03607 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.04335 131.5
[M+Na]+ 188.02529 145.8
[M+NH4]+ 183.06989 140.3
[M+K]+ 203.99923 138.9
[M-H]- 164.02879 132.4
[M+Na-2H]- 186.01074 137.6
[M]+ 165.03552 134.2
[M]- 165.03662 134.2
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