CID 47002148

1-methyl-5-(4-methyl-1,3-thiazol-2-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

Structural Information

Molecular Formula
C9H9N3O2S
SMILES
CC1=CSC(=N1)C2=CN(C(=O)NC2=O)C
InChI
InChI=1S/C9H9N3O2S/c1-5-4-15-8(10-5)6-3-12(2)9(14)11-7(6)13/h3-4H,1-2H3,(H,11,13,14)
InChIKey
FDMIAHXVJGSECA-UHFFFAOYSA-N
Compound name
1-methyl-5-(4-methyl-1,3-thiazol-2-yl)pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.04155 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.048826 145.1
[M+Na]+ 246.030768 158.2
[M-H]- 222.034274 148.6
[M+NH4]+ 241.075373 162.0
[M+K]+ 262.004708 153.2
[M+H-H2O]+ 206.038810 138.2
[M+HCOO]- 268.039751 162.3
[M+CH3COO]- 282.055401 183.6
[M+Na-2H]- 244.016216 146.4
[M]+ 223.04100142 148.3
[M]- 223.04209858 148.3
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.