CID 9631251

2-(2-(3-(benzyloxy)benzylidene)hydrazino)-n-(4-bromophenyl)-2-oxoacetamide

Structural Information

Molecular Formula
C22H18BrN3O3
SMILES
C1=CC=C(C=C1)COC2=CC=CC(=C2)/C=N/NC(=O)C(=O)NC3=CC=C(C=C3)Br
InChI
InChI=1S/C22H18BrN3O3/c23-18-9-11-19(12-10-18)25-21(27)22(28)26-24-14-17-7-4-8-20(13-17)29-15-16-5-2-1-3-6-16/h1-14H,15H2,(H,25,27)(H,26,28)/b24-14+
InChIKey
QTXJZWGLAADOHF-ZVHZXABRSA-N
Compound name
N-(4-bromophenyl)-N'-[(E)-(3-phenylmethoxyphenyl)methylideneamino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

451.05316 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 452.06044 195.5
[M+Na]+ 474.04238 198.5
[M+NH4]+ 469.08698 198.3
[M+K]+ 490.01632 196.7
[M-H]- 450.04588 200.4
[M+Na-2H]- 472.02783 201.7
[M]+ 451.05261 196.0
[M]- 451.05371 196.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.