CID 61145635

2-phenoxypyrimidin-5-amine

Structural Information

Molecular Formula
C10H9N3O
SMILES
C1=CC=C(C=C1)OC2=NC=C(C=N2)N
InChI
InChI=1S/C10H9N3O/c11-8-6-12-10(13-7-8)14-9-4-2-1-3-5-9/h1-7H,11H2
InChIKey
YMMIWOAICJBBGX-UHFFFAOYSA-N
Compound name
2-phenoxypyrimidin-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

52
Patents

187.07455 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.08183 138.0
[M+Na]+ 210.06377 146.5
[M-H]- 186.06727 141.9
[M+NH4]+ 205.10837 154.3
[M+K]+ 226.03771 143.1
[M+H-H2O]+ 170.07181 129.3
[M+HCOO]- 232.07275 161.8
[M+CH3COO]- 246.08840 151.0
[M+Na-2H]- 208.04922 147.2
[M]+ 187.07400 136.8
[M]- 187.07510 136.8
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