CID 9693405

2-(2-benzylidenehydrazino)-n-(4-methoxyphenyl)-2-oxoacetamide

Structural Information

Molecular Formula
C16H15N3O3
SMILES
COC1=CC=C(C=C1)NC(=O)C(=O)N/N=C/C2=CC=CC=C2
InChI
InChI=1S/C16H15N3O3/c1-22-14-9-7-13(8-10-14)18-15(20)16(21)19-17-11-12-5-3-2-4-6-12/h2-11H,1H3,(H,18,20)(H,19,21)/b17-11+
InChIKey
XWBYSGDNVPEIFE-GZTJUZNOSA-N
Compound name
N'-[(E)-benzylideneamino]-N-(4-methoxyphenyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.11133 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.118606 167.5
[M+Na]+ 320.100548 172.2
[M-H]- 296.104054 175.3
[M+NH4]+ 315.145153 181.9
[M+K]+ 336.074488 169.8
[M+H-H2O]+ 280.108590 158.3
[M+HCOO]- 342.109531 195.0
[M+CH3COO]- 356.125181 209.6
[M+Na-2H]- 318.085996 173.1
[M]+ 297.11078142 168.0
[M]- 297.11187858 168.0
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.