CID 66523862

3-(2-aminopyrimidin-5-yl)propan-1-ol

Structural Information

Molecular Formula
C7H11N3O
SMILES
C1=C(C=NC(=N1)N)CCCO
InChI
InChI=1S/C7H11N3O/c8-7-9-4-6(5-10-7)2-1-3-11/h4-5,11H,1-3H2,(H2,8,9,10)
InChIKey
WMEFWFJFVFFUTA-UHFFFAOYSA-N
Compound name
3-(2-aminopyrimidin-5-yl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.09021 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.09749 131.9
[M+Na]+ 176.07943 139.9
[M-H]- 152.08293 131.2
[M+NH4]+ 171.12403 149.3
[M+K]+ 192.05337 137.3
[M+H-H2O]+ 136.08747 124.8
[M+HCOO]- 198.08841 153.7
[M+CH3COO]- 212.10406 175.4
[M+Na-2H]- 174.06488 139.4
[M]+ 153.08966 130.3
[M]- 153.09076 130.3
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.