CID 9556570

N'-(4-nitrobenzylidene)-2-phenoxyacetohydrazide

Structural Information

Molecular Formula
C15H13N3O4
SMILES
C1=CC=C(C=C1)OCC(=O)N/N=C/C2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C15H13N3O4/c19-15(11-22-14-4-2-1-3-5-14)17-16-10-12-6-8-13(9-7-12)18(20)21/h1-10H,11H2,(H,17,19)/b16-10+
InChIKey
DCOPZLNBENXLIU-MHWRWJLKSA-N
Compound name
N-[(E)-(4-nitrophenyl)methylideneamino]-2-phenoxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.0906 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.09788 165.2
[M+Na]+ 322.07982 169.2
[M-H]- 298.08332 172.7
[M+NH4]+ 317.12442 178.6
[M+K]+ 338.05376 162.7
[M+H-H2O]+ 282.08786 160.4
[M+HCOO]- 344.08880 193.4
[M+CH3COO]- 358.10445 201.7
[M+Na-2H]- 320.06527 173.2
[M]+ 299.09005 164.6
[M]- 299.09115 164.6
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.