CID 3060456

Hydantoin, 1-(4-phenyl-2-thiazolyl)-

Structural Information

Molecular Formula
C12H9N3O2S
SMILES
C1C(=O)NC(=O)N1C2=NC(=CS2)C3=CC=CC=C3
InChI
InChI=1S/C12H9N3O2S/c16-10-6-15(11(17)14-10)12-13-9(7-18-12)8-4-2-1-3-5-8/h1-5,7H,6H2,(H,14,16,17)
InChIKey
BSANGDXLJFUGAL-UHFFFAOYSA-N
Compound name
1-(4-phenyl-1,3-thiazol-2-yl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

259.04153 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.048806 156.7
[M+Na]+ 282.030748 167.0
[M-H]- 258.034254 162.7
[M+NH4]+ 277.075353 173.1
[M+K]+ 298.004688 162.1
[M+H-H2O]+ 242.038790 149.2
[M+HCOO]- 304.039731 172.7
[M+CH3COO]- 318.055381 168.8
[M+Na-2H]- 280.016196 154.9
[M]+ 259.04098142 156.4
[M]- 259.04207858 156.4
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