CID 43142250

3-(5-aminopyrimidin-2-yl)phenol

Structural Information

Molecular Formula
C10H9N3O
SMILES
C1=CC(=CC(=C1)O)C2=NC=C(C=N2)N
InChI
InChI=1S/C10H9N3O/c11-8-5-12-10(13-6-8)7-2-1-3-9(14)4-7/h1-6,14H,11H2
InChIKey
SOXOFIUPGPZREF-UHFFFAOYSA-N
Compound name
3-(5-aminopyrimidin-2-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.07455 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.08183 139.0
[M+Na]+ 210.06377 148.1
[M-H]- 186.06727 141.9
[M+NH4]+ 205.10837 154.9
[M+K]+ 226.03771 143.8
[M+H-H2O]+ 170.07181 130.9
[M+HCOO]- 232.07275 161.2
[M+CH3COO]- 246.08840 151.6
[M+Na-2H]- 208.04922 146.9
[M]+ 187.07400 136.4
[M]- 187.07510 136.4
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.