CID 16769741

7-(hydroxymethyl)-3-methyl-5h-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Structural Information

Molecular Formula
C8H8N2O2S
SMILES
CC1=CSC2=NC(=CC(=O)N12)CO
InChI
InChI=1S/C8H8N2O2S/c1-5-4-13-8-9-6(3-11)2-7(12)10(5)8/h2,4,11H,3H2,1H3
InChIKey
CFFHJFDYYKPWHN-UHFFFAOYSA-N
Compound name
7-(hydroxymethyl)-3-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.03065 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.03793 138.8
[M+Na]+ 219.01987 152.6
[M+NH4]+ 214.06447 147.2
[M+K]+ 234.99381 146.4
[M-H]- 195.02337 139.6
[M+Na-2H]- 217.00532 144.0
[M]+ 196.03010 141.4
[M]- 196.03120 141.4
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.