CID 721329

3-[(2-benzoyl)-hydrazinocarbonyl]pyridine

Structural Information

Molecular Formula
C13H11N3O2
SMILES
C1=CC=C(C=C1)C(=O)NNC(=O)C2=CN=CC=C2
InChI
InChI=1S/C13H11N3O2/c17-12(10-5-2-1-3-6-10)15-16-13(18)11-7-4-8-14-9-11/h1-9H,(H,15,17)(H,16,18)
InChIKey
OBVBBNKEUHZZLJ-UHFFFAOYSA-N
Compound name
N'-benzoylpyridine-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

241.08513 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.092406 152.5
[M+Na]+ 264.074348 157.8
[M-H]- 240.077854 157.7
[M+NH4]+ 259.118953 167.2
[M+K]+ 280.048288 154.8
[M+H-H2O]+ 224.082390 143.6
[M+HCOO]- 286.083331 176.8
[M+CH3COO]- 300.098981 193.8
[M+Na-2H]- 262.059796 159.7
[M]+ 241.08458142 150.2
[M]- 241.08567858 150.2
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