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]+ 230.128776 152.0
[M+Na]+ 252.110718 161.1
[M-H]- 228.114224 156.7
[M+NH4]+ 247.155323 167.5
[M+K]+ 268.084658 157.4
[M+H-H2O]+ 212.118760 143.1
[M+HCOO]- 274.119701 175.3
[M+CH3COO]- 288.135351 194.7
[M+Na-2H]- 250.096166 159.0
[M]+ 229.12095142 153.7
[M]- 229.12204858 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.