CID 135752102

2-(2-(5-bromo-2-hydroxybenzylidene)hydrazino)-n-(4-methoxyphenyl)-2-oxoacetamide

Structural Information

Molecular Formula
C16H14BrN3O4
SMILES
COC1=CC=C(C=C1)NC(=O)C(=O)N/N=C/C2=C(C=CC(=C2)Br)O
InChI
InChI=1S/C16H14BrN3O4/c1-24-13-5-3-12(4-6-13)19-15(22)16(23)20-18-9-10-8-11(17)2-7-14(10)21/h2-9,21H,1H3,(H,19,22)(H,20,23)/b18-9+
InChIKey
UHTYQHUJFJZVSR-GIJQJNRQSA-N
Compound name
N'-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-N-(4-methoxyphenyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

391.01678 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.02406 178.0
[M+Na]+ 414.00600 185.9
[M-H]- 390.00950 186.7
[M+NH4]+ 409.05060 191.7
[M+K]+ 429.97994 174.4
[M+H-H2O]+ 374.01404 173.8
[M+HCOO]- 436.01498 200.9
[M+CH3COO]- 450.03063 219.9
[M+Na-2H]- 411.99145 182.4
[M]+ 391.01623 196.7
[M]- 391.01733 196.7
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.