CID 91203

24631-46-7

Structural Information

Molecular Formula
C12H14N2O2S
SMILES
CSCCC1C(=O)N(C(=O)N1)C2=CC=CC=C2
InChI
InChI=1S/C12H14N2O2S/c1-17-8-7-10-11(15)14(12(16)13-10)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,13,16)
InChIKey
LXZHUBYHRBZPFY-UHFFFAOYSA-N
Compound name
5-(2-methylsulfanylethyl)-3-phenylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

250.0776 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.08488 157.7
[M+Na]+ 273.06682 168.8
[M+NH4]+ 268.11142 164.8
[M+K]+ 289.04076 162.3
[M-H]- 249.07032 159.1
[M+Na-2H]- 271.05227 161.9
[M]+ 250.07705 159.9
[M]- 250.07815 159.9
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