CID 126979831

2-(cyclobutylmethyl)pyrimidin-5-amine

Structural Information

Molecular Formula
C9H13N3
SMILES
C1CC(C1)CC2=NC=C(C=N2)N
InChI
InChI=1S/C9H13N3/c10-8-5-11-9(12-6-8)4-7-2-1-3-7/h5-7H,1-4,10H2
InChIKey
DUCUUQNFHHFLCL-UHFFFAOYSA-N
Compound name
2-(cyclobutylmethyl)pyrimidin-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.11095 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.11823 133.8
[M+Na]+ 186.10017 141.7
[M+NH4]+ 181.14477 138.3
[M+K]+ 202.07411 137.3
[M-H]- 162.10367 134.3
[M+Na-2H]- 184.08562 139.2
[M]+ 163.11040 133.7
[M]- 163.11150 133.7
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

No patent data available for this compound.