CID 13379280

Brn 4508236

Structural Information

Molecular Formula
C12H15N3O2S
SMILES
C1CCN(CC1)C(=O)C2=CN=C3N(C2=O)CCS3
InChI
InChI=1S/C12H15N3O2S/c16-10(14-4-2-1-3-5-14)9-8-13-12-15(11(9)17)6-7-18-12/h8H,1-7H2
InChIKey
NOOYQKIKSLCUBA-UHFFFAOYSA-N
Compound name
6-(piperidine-1-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.0885 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.09578 158.6
[M+Na]+ 288.07772 166.0
[M-H]- 264.08122 161.8
[M+NH4]+ 283.12232 174.3
[M+K]+ 304.05166 162.3
[M+H-H2O]+ 248.08576 150.6
[M+HCOO]- 310.08670 169.6
[M+CH3COO]- 324.10235 169.1
[M+Na-2H]- 286.06317 158.6
[M]+ 265.08795 156.6
[M]- 265.08905 156.6
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.