CID 135411492

303064-41-7

Structural Information

Molecular Formula
C15H12Br2N2O3
SMILES
C1=CC(=CC=C1OCC(=O)N/N=C/C2=C(C=CC(=C2)Br)O)Br
InChI
InChI=1S/C15H12Br2N2O3/c16-11-1-4-13(5-2-11)22-9-15(21)19-18-8-10-7-12(17)3-6-14(10)20/h1-8,20H,9H2,(H,19,21)/b18-8+
InChIKey
LPNSUQAPWYKYAD-QGMBQPNBSA-N
Compound name
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-2-(4-bromophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

425.92148 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 426.92876 169.0
[M+Na]+ 448.91070 176.8
[M-H]- 424.91420 177.3
[M+NH4]+ 443.95530 182.7
[M+K]+ 464.88464 160.8
[M+H-H2O]+ 408.91874 173.6
[M+HCOO]- 470.91968 185.8
[M+CH3COO]- 484.93533 223.4
[M+Na-2H]- 446.89615 173.8
[M]+ 425.92093 203.1
[M]- 425.92203 203.1
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.