CID 3060459

Brn 5759012

Structural Information

Molecular Formula
C13H11N3O3S
SMILES
COC1=CC=C(C=C1)C2=CSC(=N2)N3CC(=O)NC3=O
InChI
InChI=1S/C13H11N3O3S/c1-19-9-4-2-8(3-5-9)10-7-20-13(14-10)16-6-11(17)15-12(16)18/h2-5,7H,6H2,1H3,(H,15,17,18)
InChIKey
NUDQEQNODBLJCN-UHFFFAOYSA-N
Compound name
1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.05212 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.05940 164.0
[M+Na]+ 312.04134 174.4
[M-H]- 288.04484 170.3
[M+NH4]+ 307.08594 179.3
[M+K]+ 328.01528 169.8
[M+H-H2O]+ 272.04938 156.6
[M+HCOO]- 334.05032 179.8
[M+CH3COO]- 348.06597 175.9
[M+Na-2H]- 310.02679 161.3
[M]+ 289.05157 165.9
[M]- 289.05267 165.9
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

No patent data available for this compound.