CID 1402791

4,6-dimethylisothiazolo[5,4-b]pyridin-3-amine

Structural Information

Molecular Formula
C8H9N3S
SMILES
CC1=CC(=NC2=C1C(=NS2)N)C
InChI
InChI=1S/C8H9N3S/c1-4-3-5(2)10-8-6(4)7(9)11-12-8/h3H,1-2H3,(H2,9,11)
InChIKey
YIHZHHMMABBXRE-UHFFFAOYSA-N
Compound name
4,6-dimethyl-[1,2]thiazolo[5,4-b]pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

179.05171 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.05899 134.9
[M+Na]+ 202.04093 148.5
[M+NH4]+ 197.08553 144.4
[M+K]+ 218.01487 141.8
[M-H]- 178.04443 137.5
[M+Na-2H]- 200.02638 141.1
[M]+ 179.05116 138.1
[M]- 179.05226 138.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.