CID 5469562

4-pyridinecarboxylic acid, 2-(2-thienylmethylene)hydrazide

Structural Information

Molecular Formula
C11H9N3OS
SMILES
C1=CSC(=C1)/C=N/NC(=O)C2=CC=NC=C2
InChI
InChI=1S/C11H9N3OS/c15-11(9-3-5-12-6-4-9)14-13-8-10-2-1-7-16-10/h1-8H,(H,14,15)/b13-8+
InChIKey
VQHKTXKJAYPSHY-MDWZMJQESA-N
Compound name
N-[(E)-thiophen-2-ylmethylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

231.04663 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.05391 149.7
[M+Na]+ 254.03585 160.7
[M+NH4]+ 249.08045 158.1
[M+K]+ 270.00979 153.8
[M-H]- 230.03935 154.1
[M+Na-2H]- 252.02130 158.0
[M]+ 231.04608 152.7
[M]- 231.04718 152.7
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