CID 3777900

4-(2-methoxyethoxy)-6-methylpyrimidin-2-amine

Structural Information

Molecular Formula
C8H13N3O2
SMILES
CC1=CC(=NC(=N1)N)OCCOC
InChI
InChI=1S/C8H13N3O2/c1-6-5-7(11-8(9)10-6)13-4-3-12-2/h5H,3-4H2,1-2H3,(H2,9,10,11)
InChIKey
VCJHOFUOIQHNBC-UHFFFAOYSA-N
Compound name
4-(2-methoxyethoxy)-6-methylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

8
Patents

183.10077 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.10805 138.9
[M+Na]+ 206.08999 147.7
[M-H]- 182.09349 139.8
[M+NH4]+ 201.13459 156.0
[M+K]+ 222.06393 146.3
[M+H-H2O]+ 166.09803 131.3
[M+HCOO]- 228.09897 162.0
[M+CH3COO]- 242.11462 184.2
[M+Na-2H]- 204.07544 145.5
[M]+ 183.10022 141.3
[M]- 183.10132 141.3
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