CID 5428472

N'-(2-ethoxybenzylidene)-2-(4-nitrophenoxy)acetohydrazide

Structural Information

Molecular Formula
C17H17N3O5
SMILES
CCOC1=CC=CC=C1/C=N\NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C17H17N3O5/c1-2-24-16-6-4-3-5-13(16)11-18-19-17(21)12-25-15-9-7-14(8-10-15)20(22)23/h3-11H,2,12H2,1H3,(H,19,21)/b18-11-
InChIKey
LERUXRSZTMSUKL-WQRHYEAKSA-N
Compound name
N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2-(4-nitrophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.11682 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.12410 177.5
[M+Na]+ 366.10604 181.3
[M-H]- 342.10954 185.0
[M+NH4]+ 361.15064 189.2
[M+K]+ 382.07998 175.1
[M+H-H2O]+ 326.11408 172.2
[M+HCOO]- 388.11502 205.1
[M+CH3COO]- 402.13067 211.0
[M+Na-2H]- 364.09149 184.0
[M]+ 343.11627 179.3
[M]- 343.11737 179.3
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.