CID 9626523

N'-(3-nitrobenzylidene)-2-(4-nitrophenoxy)acetohydrazide

Structural Information

Molecular Formula
C15H12N4O6
SMILES
C1=CC(=CC(=C1)[N+](=O)[O-])/C=N/NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C15H12N4O6/c20-15(10-25-14-6-4-12(5-7-14)18(21)22)17-16-9-11-2-1-3-13(8-11)19(23)24/h1-9H,10H2,(H,17,20)/b16-9+
InChIKey
XCAVEILMGDLREY-CXUHLZMHSA-N
Compound name
2-(4-nitrophenoxy)-N-[(E)-(3-nitrophenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.07568 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.08296 182.6
[M+Na]+ 367.06490 188.5
[M+NH4]+ 362.10950 191.0
[M+K]+ 383.03884 197.1
[M-H]- 343.06840 178.7
[M+Na-2H]- 365.05035 183.9
[M]+ 344.07513 184.4
[M]- 344.07623 184.4
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.