CID 9574334

N'-(4-nitrobenzyliden)-2-pyridincarboxyamidrazone

Structural Information

Molecular Formula
C13H11N5O2
SMILES
C1=CC=NC(=C1)/C(=N/N=C/C2=CC=C(C=C2)[N+](=O)[O-])/N
InChI
InChI=1S/C13H11N5O2/c14-13(12-3-1-2-8-15-12)17-16-9-10-4-6-11(7-5-10)18(19)20/h1-9H,(H2,14,17)/b16-9+
InChIKey
IQWMWSXOLCLEHD-CXUHLZMHSA-N
Compound name
N'-[(E)-(4-nitrophenyl)methylideneamino]pyridine-2-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

269.09128 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.09856 156.3
[M+Na]+ 292.08050 161.1
[M-H]- 268.08400 163.7
[M+NH4]+ 287.12510 169.9
[M+K]+ 308.05444 154.2
[M+H-H2O]+ 252.08854 150.9
[M+HCOO]- 314.08948 185.4
[M+CH3COO]- 328.10513 200.9
[M+Na-2H]- 290.06595 165.7
[M]+ 269.09073 153.0
[M]- 269.09183 153.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.