CID 49758794

2-cyclobutylpyrimidin-5-amine

Structural Information

Molecular Formula
C8H11N3
SMILES
C1CC(C1)C2=NC=C(C=N2)N
InChI
InChI=1S/C8H11N3/c9-7-4-10-8(11-5-7)6-2-1-3-6/h4-6H,1-3,9H2
InChIKey
SUYUPUXYACCYHP-UHFFFAOYSA-N
Compound name
2-cyclobutylpyrimidin-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

149.09529 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.10257 129.7
[M+Na]+ 172.08451 136.2
[M-H]- 148.08801 133.0
[M+NH4]+ 167.12911 141.3
[M+K]+ 188.05845 136.9
[M+H-H2O]+ 132.09255 116.5
[M+HCOO]- 194.09349 150.6
[M+CH3COO]- 208.10914 180.5
[M+Na-2H]- 170.06996 136.7
[M]+ 149.09474 134.7
[M]- 149.09584 134.7
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