CID 229272

2-methyl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine

Structural Information

Molecular Formula
C6H6N4S
SMILES
CC1=NC2=C(N=CN=C2S1)N
InChI
InChI=1S/C6H6N4S/c1-3-10-4-5(7)8-2-9-6(4)11-3/h2H,1H3,(H2,7,8,9)
InChIKey
KBDDBVUGXFDYMV-UHFFFAOYSA-N
Compound name
2-methyl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

166.03131 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.038586 129.0
[M+Na]+ 189.020528 142.1
[M-H]- 165.024034 130.8
[M+NH4]+ 184.065133 149.4
[M+K]+ 204.994468 138.4
[M+H-H2O]+ 149.028570 122.5
[M+HCOO]- 211.029511 148.2
[M+CH3COO]- 225.045161 143.5
[M+Na-2H]- 187.005976 135.0
[M]+ 166.03076142 132.0
[M]- 166.03185858 132.0
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

patents stripe