CID 50987607

5-(5-bromothiophen-2-yl)-5-methylimidazolidine-2,4-dione

Structural Information

Molecular Formula
C8H7BrN2O2S
SMILES
CC1(C(=O)NC(=O)N1)C2=CC=C(S2)Br
InChI
InChI=1S/C8H7BrN2O2S/c1-8(4-2-3-5(9)14-4)6(12)10-7(13)11-8/h2-3H,1H3,(H2,10,11,12,13)
InChIKey
BWNAJTWFYYYMGM-UHFFFAOYSA-N
Compound name
5-(5-bromothiophen-2-yl)-5-methylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.94116 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.94844 143.3
[M+Na]+ 296.93038 157.6
[M-H]- 272.93388 149.1
[M+NH4]+ 291.97498 165.9
[M+K]+ 312.90432 145.3
[M+H-H2O]+ 256.93842 145.2
[M+HCOO]- 318.93936 157.2
[M+CH3COO]- 332.95501 158.2
[M+Na-2H]- 294.91583 145.2
[M]+ 273.94061 161.0
[M]- 273.94171 161.0
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.