CID 252884

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

Structural Information

Molecular Formula
C6H6N4O
SMILES
CC1=NOC2=NC=NC(=C12)N
InChI
InChI=1S/C6H6N4O/c1-3-4-5(7)8-2-9-6(4)11-10-3/h2H,1H3,(H2,7,8,9)
InChIKey
LUXCYIYHBZIANP-UHFFFAOYSA-N
Compound name
3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

150.05415 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.06143 126.5
[M+Na]+ 173.04337 138.9
[M-H]- 149.04687 128.6
[M+NH4]+ 168.08797 145.4
[M+K]+ 189.01731 137.4
[M+H-H2O]+ 133.05141 119.2
[M+HCOO]- 195.05235 150.0
[M+CH3COO]- 209.06800 141.3
[M+Na-2H]- 171.02882 136.4
[M]+ 150.05360 129.1
[M]- 150.05470 129.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe