CID 135520153

2-(4-bromophenoxy)-n-[(z)-(4-chloro-2-oxo-indolin-3-ylidene)amino]acetamide

Structural Information

Molecular Formula
C16H11BrClN3O3
SMILES
C1=CC2=C(C(=C1)Cl)C(=C(N2)O)N=NC(=O)COC3=CC=C(C=C3)Br
InChI
InChI=1S/C16H11BrClN3O3/c17-9-4-6-10(7-5-9)24-8-13(22)20-21-15-14-11(18)2-1-3-12(14)19-16(15)23/h1-7,19,23H,8H2
InChIKey
OIYQXWKYLOOUAB-UHFFFAOYSA-N
Compound name
2-(4-bromophenoxy)-N-[(4-chloro-2-hydroxy-1H-indol-3-yl)imino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

406.96722 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.97450 180.8
[M+Na]+ 429.95644 193.7
[M-H]- 405.95994 190.4
[M+NH4]+ 425.00104 197.3
[M+K]+ 445.93038 180.1
[M+H-H2O]+ 389.96448 178.8
[M+HCOO]- 451.96542 199.9
[M+CH3COO]- 465.98107 218.3
[M+Na-2H]- 427.94189 186.6
[M]+ 406.96667 204.6
[M]- 406.96777 204.6
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.