CID 6861470

(1e,2e)-bis(3-nitrobenzylidene)hydrazine

Structural Information

Molecular Formula
C14H10N4O4
SMILES
C1=CC(=CC(=C1)[N+](=O)[O-])/C=N/N=C/C2=CC(=CC=C2)[N+](=O)[O-]
InChI
InChI=1S/C14H10N4O4/c19-17(20)13-5-1-3-11(7-13)9-15-16-10-12-4-2-6-14(8-12)18(21)22/h1-10H/b15-9+,16-10+
InChIKey
OFKOPKJTGHUWLZ-KAVGSWPWSA-N
Compound name
(E)-1-(3-nitrophenyl)-N-[(E)-(3-nitrophenyl)methylideneamino]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

298.0702 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.07748 166.2
[M+Na]+ 321.05942 170.4
[M-H]- 297.06292 174.9
[M+NH4]+ 316.10402 179.1
[M+K]+ 337.03336 159.7
[M+H-H2O]+ 281.06746 165.5
[M+HCOO]- 343.06840 196.4
[M+CH3COO]- 357.08405 199.6
[M+Na-2H]- 319.04487 176.0
[M]+ 298.06965 163.7
[M]- 298.07075 163.7
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.