CID 819560

4-ethyl-6-methylpyrimidin-2-amine

Structural Information

Molecular Formula
C7H11N3
SMILES
CCC1=NC(=NC(=C1)C)N
InChI
InChI=1S/C7H11N3/c1-3-6-4-5(2)9-7(8)10-6/h4H,3H2,1-2H3,(H2,8,9,10)
InChIKey
NSSCQYIZLNIDAO-UHFFFAOYSA-N
Compound name
4-ethyl-6-methylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

137.09529 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.102566 128.4
[M+Na]+ 160.084508 137.9
[M-H]- 136.088014 129.5
[M+NH4]+ 155.129113 147.7
[M+K]+ 176.058448 135.8
[M+H-H2O]+ 120.092550 121.6
[M+HCOO]- 182.093491 151.5
[M+CH3COO]- 196.109141 177.0
[M+Na-2H]- 158.069956 135.7
[M]+ 137.09474142 127.7
[M]- 137.09583858 127.7
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

patents stripe