CID 4357468

4,4'-dinitrohydrazobenzene

Structural Information

Molecular Formula
C12H10N4O4
SMILES
C1=CC(=CC=C1NNC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C12H10N4O4/c17-15(18)11-5-1-9(2-6-11)13-14-10-3-7-12(8-4-10)16(19)20/h1-8,13-14H
InChIKey
YYEMGPZOKZIEAB-UHFFFAOYSA-N
Compound name
1,2-bis(4-nitrophenyl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

274.0702 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.07748 154.9
[M+Na]+ 297.05942 158.4
[M-H]- 273.06292 161.2
[M+NH4]+ 292.10402 167.4
[M+K]+ 313.03336 147.6
[M+H-H2O]+ 257.06746 155.1
[M+HCOO]- 319.06840 182.6
[M+CH3COO]- 333.08405 191.7
[M+Na-2H]- 295.04487 165.4
[M]+ 274.06965 149.8
[M]- 274.07075 149.8
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

patents stripe