CID 253353

1-(4-nitrophenyl)-2-[(3-nitrophenyl)methylidene]hydrazine

Structural Information

Molecular Formula
C13H10N4O4
SMILES
C1=CC(=CC(=C1)[N+](=O)[O-])C=NNC2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C13H10N4O4/c18-16(19)12-6-4-11(5-7-12)15-14-9-10-2-1-3-13(8-10)17(20)21/h1-9,15H
InChIKey
DUJGQCJQVKGBBA-UHFFFAOYSA-N
Compound name
4-nitro-N-[(3-nitrophenyl)methylideneamino]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

286.0702 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.07748 164.5
[M+Na]+ 309.05942 177.9
[M+NH4]+ 304.10402 171.6
[M+K]+ 325.03336 176.0
[M-H]- 285.06292 172.0
[M+Na-2H]- 307.04487 172.7
[M]+ 286.06965 168.2
[M]- 286.07075 168.2
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.