CID 57476591

920313-63-9

Structural Information

Molecular Formula
C6H6N4OS
SMILES
COC1=NC=C2C(=N1)SC(=N2)N
InChI
InChI=1S/C6H6N4OS/c1-11-6-8-2-3-4(10-6)12-5(7)9-3/h2H,1H3,(H2,7,9)
InChIKey
KFKXUFHFJAKEKI-UHFFFAOYSA-N
Compound name
5-methoxy-[1,3]thiazolo[5,4-d]pyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

182.02623 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.03351 132.1
[M+Na]+ 205.01545 145.1
[M-H]- 181.01895 133.9
[M+NH4]+ 200.06005 151.8
[M+K]+ 220.98939 141.8
[M+H-H2O]+ 165.02349 125.5
[M+HCOO]- 227.02443 151.6
[M+CH3COO]- 241.04008 146.5
[M+Na-2H]- 203.00090 138.3
[M]+ 182.02568 136.5
[M]- 182.02678 136.5
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