CID 135499601

N'-[(4z)-4-[(4-chlorophenyl)methylene]-5-oxo-1h-imidazol-2-yl]pyridine-4-carbohydrazide

Structural Information

Molecular Formula
C16H12ClN5O2
SMILES
C1=CC(=CC=C1/C=C\2/C(=O)NC(=N2)NNC(=O)C3=CC=NC=C3)Cl
InChI
InChI=1S/C16H12ClN5O2/c17-12-3-1-10(2-4-12)9-13-15(24)20-16(19-13)22-21-14(23)11-5-7-18-8-6-11/h1-9H,(H,21,23)(H2,19,20,22,24)/b13-9-
InChIKey
ZJDAAPKHSYPXDK-LCYFTJDESA-N
Compound name
N'-[(4Z)-4-[(4-chlorophenyl)methylidene]-5-oxo-1H-imidazol-2-yl]pyridine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

341.06796 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.07524 177.7
[M+Na]+ 364.05718 185.4
[M-H]- 340.06068 182.7
[M+NH4]+ 359.10178 188.0
[M+K]+ 380.03112 177.8
[M+H-H2O]+ 324.06522 167.5
[M+HCOO]- 386.06616 194.0
[M+CH3COO]- 400.08181 187.1
[M+Na-2H]- 362.04263 180.4
[M]+ 341.06741 175.8
[M]- 341.06851 175.8
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.