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

19
Patents

241.08513 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.09241 152.5
[M+Na]+ 264.07435 157.8
[M-H]- 240.07785 157.7
[M+NH4]+ 259.11895 167.2
[M+K]+ 280.04829 154.8
[M+H-H2O]+ 224.08239 143.6
[M+HCOO]- 286.08333 176.8
[M+CH3COO]- 300.09898 193.8
[M+Na-2H]- 262.05980 159.7
[M]+ 241.08458 150.2
[M]- 241.08568 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