CID 5927868

2-(4-acetamidophenoxy)-n-[(e)-benzylideneamino]acetamide

Structural Information

Molecular Formula
C17H17N3O3
SMILES
CC(=O)NC1=CC=C(C=C1)OCC(=O)N/N=C/C2=CC=CC=C2
InChI
InChI=1S/C17H17N3O3/c1-13(21)19-15-7-9-16(10-8-15)23-12-17(22)20-18-11-14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,19,21)(H,20,22)/b18-11+
InChIKey
GRYNJPBEMWVVAK-WOJGMQOQSA-N
Compound name
2-(4-acetamidophenoxy)-N-[(E)-benzylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.12698 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.13426 171.8
[M+Na]+ 334.11620 175.9
[M-H]- 310.11970 179.3
[M+NH4]+ 329.16080 185.4
[M+K]+ 350.09014 173.3
[M+H-H2O]+ 294.12424 162.2
[M+HCOO]- 356.12518 198.9
[M+CH3COO]- 370.14083 213.3
[M+Na-2H]- 332.10165 176.8
[M]+ 311.12643 172.6
[M]- 311.12753 172.6
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.