CID 853509

N-(2-methoxyphenyl)-4,6-dimethylpyrimidin-2-amine

Structural Information

Molecular Formula
C13H15N3O
SMILES
CC1=CC(=NC(=N1)NC2=CC=CC=C2OC)C
InChI
InChI=1S/C13H15N3O/c1-9-8-10(2)15-13(14-9)16-11-6-4-5-7-12(11)17-3/h4-8H,1-3H3,(H,14,15,16)
InChIKey
SACRLESGJIHCMH-UHFFFAOYSA-N
Compound name
N-(2-methoxyphenyl)-4,6-dimethylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

229.1215 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.12878 152.0
[M+Na]+ 252.11072 161.1
[M-H]- 228.11422 156.7
[M+NH4]+ 247.15532 167.5
[M+K]+ 268.08466 157.4
[M+H-H2O]+ 212.11876 143.1
[M+HCOO]- 274.11970 175.3
[M+CH3COO]- 288.13535 194.7
[M+Na-2H]- 250.09617 159.0
[M]+ 229.12095 153.7
[M]- 229.12205 153.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.