CID 21156138

79771-29-2

Structural Information

Molecular Formula
C13H10N4O4
SMILES
C1=CC(=CC=C1C(=O)N(C(=O)C2=CC=NC=C2)N)[N+](=O)[O-]
InChI
InChI=1S/C13H10N4O4/c14-16(13(19)10-5-7-15-8-6-10)12(18)9-1-3-11(4-2-9)17(20)21/h1-8H,14H2
InChIKey
NBHGVCILLRYVSO-UHFFFAOYSA-N
Compound name
N-(4-nitrobenzoyl)pyridine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

286.0702 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.07748 158.8
[M+Na]+ 309.05942 170.2
[M+NH4]+ 304.10402 164.6
[M+K]+ 325.03336 169.0
[M-H]- 285.06292 163.2
[M+Na-2H]- 307.04487 166.3
[M]+ 286.06965 161.2
[M]- 286.07075 161.2
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

No patent data available for this compound.