CID 11360513

N-[4-(4-nitrophenoxy)phenyl]-2-phenoxy-acetamide

Structural Information

Molecular Formula
C20H16N2O5
SMILES
C1=CC=C(C=C1)OCC(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C20H16N2O5/c23-20(14-26-17-4-2-1-3-5-17)21-15-6-10-18(11-7-15)27-19-12-8-16(9-13-19)22(24)25/h1-13H,14H2,(H,21,23)
InChIKey
PSOUIJMLZIMJAA-UHFFFAOYSA-N
Compound name
N-[4-(4-nitrophenoxy)phenyl]-2-phenoxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

364.10593 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.11321 183.2
[M+Na]+ 387.09515 186.6
[M-H]- 363.09865 192.3
[M+NH4]+ 382.13975 192.9
[M+K]+ 403.06909 179.1
[M+H-H2O]+ 347.10319 177.0
[M+HCOO]- 409.10413 208.1
[M+CH3COO]- 423.11978 210.2
[M+Na-2H]- 385.08060 189.6
[M]+ 364.10538 182.9
[M]- 364.10648 182.9
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

patents stripe