CID 21162175

1880205-67-3

Structural Information

Molecular Formula

C₁₁H₉BrN₂O₂

SMILES

C1CC2(C3=C1C=CC(=C3)Br)C(=O)NC(=O)N2

InChI

InChI=1S/C11H9BrN2O2/c12-7-2-1-6-3-4-11(8(6)5-7)9(15)13-10(16)14-11/h1-2,5H,3-4H2,(H2,13,14,15,16)

InChIKey

ZHUCFBRTGREBGZ-UHFFFAOYSA-N

Compound name

5-bromospiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 279.98474 Da
Monoisotopic Mass: 1.6
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]+	280.992016	156.5
[M+Na]+	302.973958	169.5
[M-H]-	278.977464	161.5
[M+NH4]+	298.018563	179.2
[M+K]+	318.947898	156.8
[M+H-H2O]+	262.982000	157.4
[M+HCOO]-	324.982941	172.3
[M+CH3COO]-	338.998591	170.2
[M+Na-2H]-	300.959406	160.4
[M]+	279.98419142	170.9
[M]-	279.98528858	170.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe