CID 2757162

N-(3-bromophenyl)succinimide

Structural Information

Molecular Formula

C₁₀H₈BrNO₂

SMILES

C1CC(=O)N(C1=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C10H8BrNO2/c11-7-2-1-3-8(6-7)12-9(13)4-5-10(12)14/h1-3,6H,4-5H2

InChIKey

PCDLFYCLBOATJZ-UHFFFAOYSA-N

Compound name

1-(3-bromophenyl)pyrrolidine-2,5-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 252.97385 Da
Monoisotopic Mass: 1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	253.981126	146.0
[M+Na]+	275.963068	158.5
[M-H]-	251.966574	154.4
[M+NH4]+	271.007673	167.3
[M+K]+	291.937008	147.5
[M+H-H2O]+	235.971110	145.8
[M+HCOO]-	297.972051	166.8
[M+CH3COO]-	311.987701	189.1
[M+Na-2H]-	273.948516	150.7
[M]+	252.97330142	163.5
[M]-	252.97439858	163.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.