CID 1377374

Oprea1_038009

Structural Information

Molecular Formula
C28H24N2O3
SMILES
C1=CC=C(C=C1)CC(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)NC(=O)CC4=CC=CC=C4
InChI
InChI=1S/C28H24N2O3/c31-27(19-21-7-3-1-4-8-21)29-23-11-15-25(16-12-23)33-26-17-13-24(14-18-26)30-28(32)20-22-9-5-2-6-10-22/h1-18H,19-20H2,(H,29,31)(H,30,32)
InChIKey
YZOIUWABEAVQHW-UHFFFAOYSA-N
Compound name
2-phenyl-N-[4-[4-[(2-phenylacetyl)amino]phenoxy]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

436.17868 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 437.18596 206.4
[M+Na]+ 459.16790 208.8
[M-H]- 435.17140 217.6
[M+NH4]+ 454.21250 213.2
[M+K]+ 475.14184 202.9
[M+H-H2O]+ 419.17594 194.1
[M+HCOO]- 481.17688 229.0
[M+CH3COO]- 495.19253 233.1
[M+Na-2H]- 457.15335 209.2
[M]+ 436.17813 205.3
[M]- 436.17923 205.3
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

patents stripe