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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.99202 156.5
[M+Na]+ 302.97396 169.5
[M-H]- 278.97746 161.5
[M+NH4]+ 298.01856 179.2
[M+K]+ 318.94790 156.8
[M+H-H2O]+ 262.98200 157.4
[M+HCOO]- 324.98294 172.3
[M+CH3COO]- 338.99859 170.2
[M+Na-2H]- 300.95941 160.4
[M]+ 279.98419 170.9
[M]- 279.98529 170.9
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

patents stripe