CID 9561286

Acetaldehyde, phenyl-, (5-nitro-2-pyridyl)hydrazone

Structural Information

Molecular Formula
C13H12N4O2
SMILES
C1=CC=C(C=C1)C/C=N/NC2=NC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C13H12N4O2/c18-17(19)12-6-7-13(14-10-12)16-15-9-8-11-4-2-1-3-5-11/h1-7,9-10H,8H2,(H,14,16)/b15-9+
InChIKey
UPXKGPLYXKTBLA-OQLLNIDSSA-N
Compound name
5-nitro-N-[(E)-2-phenylethylideneamino]pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.09604 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.103316 153.9
[M+Na]+ 279.085258 159.1
[M-H]- 255.088764 160.3
[M+NH4]+ 274.129863 168.0
[M+K]+ 295.059198 151.7
[M+H-H2O]+ 239.093300 148.9
[M+HCOO]- 301.094241 182.0
[M+CH3COO]- 315.109891 195.0
[M+Na-2H]- 277.070706 164.4
[M]+ 256.09549142 151.8
[M]- 256.09658858 151.8
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.