CID 23621069

Bsfbqxbpjtykab-uhfffaoysa-n

Structural Information

Molecular Formula
C10H18N4O2S
SMILES
CC(C)(C)C1=CNN(S1)N2C(CN(C2=O)C)O
InChI
InChI=1S/C10H18N4O2S/c1-10(2,3)7-5-11-14(17-7)13-8(15)6-12(4)9(13)16/h5,8,11,15H,6H2,1-4H3
InChIKey
BSFBQXBPJTYKAB-UHFFFAOYSA-N
Compound name
3-(5-tert-butyl-3H-thiadiazol-2-yl)-4-hydroxy-1-methylimidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.11505 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.122326 163.0
[M+Na]+ 281.104268 171.9
[M-H]- 257.107774 163.0
[M+NH4]+ 276.148873 178.1
[M+K]+ 297.078208 168.6
[M+H-H2O]+ 241.112310 156.8
[M+HCOO]- 303.113251 171.9
[M+CH3COO]- 317.128901 188.9
[M+Na-2H]- 279.089716 158.7
[M]+ 258.11450142 162.1
[M]- 258.11559858 162.1
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.