CID 506605

N-(1,3-thiazol-2-yl)pyridine-3-carboxamide

Structural Information

Molecular Formula
C9H7N3OS
SMILES
C1=CC(=CN=C1)C(=O)NC2=NC=CS2
InChI
InChI=1S/C9H7N3OS/c13-8(7-2-1-3-10-6-7)12-9-11-4-5-14-9/h1-6H,(H,11,12,13)
InChIKey
XOXGTZLXSYSIRP-UHFFFAOYSA-N
Compound name
N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

11
Patents

205.03099 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.03827 140.9
[M+Na]+ 228.02021 149.6
[M-H]- 204.02371 145.7
[M+NH4]+ 223.06481 159.1
[M+K]+ 243.99415 146.3
[M+H-H2O]+ 188.02825 133.1
[M+HCOO]- 250.02919 160.7
[M+CH3COO]- 264.04484 154.0
[M+Na-2H]- 226.00566 145.2
[M]+ 205.03044 141.8
[M]- 205.03154 141.8
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

No patent data available for this compound.