CID 165950539

3-methyl-[1,2]thiazolo[4,5-b]pyridine-6-carboxylic acid

Structural Information

Molecular Formula
C8H6N2O2S
SMILES
CC1=NSC2=C1N=CC(=C2)C(=O)O
InChI
InChI=1S/C8H6N2O2S/c1-4-7-6(13-10-4)2-5(3-9-7)8(11)12/h2-3H,1H3,(H,11,12)
InChIKey
SZFOWHIHHZICBI-UHFFFAOYSA-N
Compound name
3-methyl-[1,2]thiazolo[4,5-b]pyridine-6-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.015 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.02228 138.0
[M+Na]+ 217.00422 150.9
[M+NH4]+ 212.04882 146.2
[M+K]+ 232.97816 145.4
[M-H]- 193.00772 138.5
[M+Na-2H]- 214.98967 143.1
[M]+ 194.01445 140.3
[M]- 194.01555 140.3
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

No patent data available for this compound.