CID 46341

64011-58-1

Structural Information

Molecular Formula
C15H20N2O2S
SMILES
C1CCC(CC1)CCC2(C(=O)NC(=O)N2)C3=CC=CS3
InChI
InChI=1S/C15H20N2O2S/c18-13-15(17-14(19)16-13,12-7-4-10-20-12)9-8-11-5-2-1-3-6-11/h4,7,10-11H,1-3,5-6,8-9H2,(H2,16,17,18,19)
InChIKey
YXVQHBULBXLMFC-UHFFFAOYSA-N
Compound name
5-(2-cyclohexylethyl)-5-thiophen-2-ylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.12454 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.13182 169.3
[M+Na]+ 315.11376 174.7
[M-H]- 291.11726 173.3
[M+NH4]+ 310.15836 186.4
[M+K]+ 331.08770 169.4
[M+H-H2O]+ 275.12180 162.6
[M+HCOO]- 337.12274 179.8
[M+CH3COO]- 351.13839 178.5
[M+Na-2H]- 313.09921 165.4
[M]+ 292.12399 163.6
[M]- 292.12509 163.6
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.