CID 51061050

2-(2-(2-((4-chlorobenzyl)oxy)benzylidene)hydrazino)-n-(2-methylphenyl)-2-oxoacetamide

Structural Information

Molecular Formula
C23H20ClN3O3
SMILES
CC1=CC=CC=C1NC(=O)C(=O)N/N=C/C2=CC=CC=C2OCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C23H20ClN3O3/c1-16-6-2-4-8-20(16)26-22(28)23(29)27-25-14-18-7-3-5-9-21(18)30-15-17-10-12-19(24)13-11-17/h2-14H,15H2,1H3,(H,26,28)(H,27,29)/b25-14+
InChIKey
VTEYULDZGBULSO-AFUMVMLFSA-N
Compound name
N'-[(E)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-N-(2-methylphenyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

421.11932 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 422.12660 201.6
[M+Na]+ 444.10854 207.0
[M-H]- 420.11204 212.1
[M+NH4]+ 439.15314 211.7
[M+K]+ 460.08248 201.2
[M+H-H2O]+ 404.11658 191.3
[M+HCOO]- 466.11752 223.3
[M+CH3COO]- 480.13317 232.5
[M+Na-2H]- 442.09399 204.1
[M]+ 421.11877 205.2
[M]- 421.11987 205.2
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.