CID 9565512

2-(2-(5-bromo-2-methoxybenzylidene)hydrazino)-2-oxo-n-phenylacetamide

Structural Information

Molecular Formula
C16H14BrN3O3
SMILES
COC1=C(C=C(C=C1)Br)/C=N/NC(=O)C(=O)NC2=CC=CC=C2
InChI
InChI=1S/C16H14BrN3O3/c1-23-14-8-7-12(17)9-11(14)10-18-20-16(22)15(21)19-13-5-3-2-4-6-13/h2-10H,1H3,(H,19,21)(H,20,22)/b18-10+
InChIKey
LNCUNBLSKALYOE-VCHYOVAHSA-N
Compound name
N'-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-N-phenyloxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

375.02185 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.02913 175.4
[M+Na]+ 398.01107 177.0
[M+NH4]+ 393.05567 178.1
[M+K]+ 413.98501 176.9
[M-H]- 374.01457 178.0
[M+Na-2H]- 395.99652 179.5
[M]+ 375.02130 174.9
[M]- 375.02240 174.9
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.

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No patent data available for this compound.