CID 233530

5-methyl-5-(thiophen-2-yl)imidazolidine-2,4-dione

Structural Information

Molecular Formula
C8H8N2O2S
SMILES
CC1(C(=O)NC(=O)N1)C2=CC=CS2
InChI
InChI=1S/C8H8N2O2S/c1-8(5-3-2-4-13-5)6(11)9-7(12)10-8/h2-4H,1H3,(H2,9,10,11,12)
InChIKey
WDAZLLRXKDSCLR-UHFFFAOYSA-N
Compound name
5-methyl-5-thiophen-2-ylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

196.03065 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.03793 140.5
[M+Na]+ 219.01987 150.5
[M-H]- 195.02337 143.1
[M+NH4]+ 214.06447 162.1
[M+K]+ 234.99381 146.6
[M+H-H2O]+ 179.02791 135.6
[M+HCOO]- 241.02885 155.9
[M+CH3COO]- 255.04450 153.3
[M+Na-2H]- 217.00532 140.6
[M]+ 196.03010 138.8
[M]- 196.03120 138.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe