CID 43552092

1-(4,6-dimethoxypyrimidin-5-yl)-n-methylmethanamine

Structural Information

Molecular Formula
C8H13N3O2
SMILES
CNCC1=C(N=CN=C1OC)OC
InChI
InChI=1S/C8H13N3O2/c1-9-4-6-7(12-2)10-5-11-8(6)13-3/h5,9H,4H2,1-3H3
InChIKey
GKIWZJVYRCZDHO-UHFFFAOYSA-N
Compound name
1-(4,6-dimethoxypyrimidin-5-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.10077 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.10805 138.4
[M+Na]+ 206.08999 147.2
[M-H]- 182.09349 139.8
[M+NH4]+ 201.13459 155.8
[M+K]+ 222.06393 146.2
[M+H-H2O]+ 166.09803 130.8
[M+HCOO]- 228.09897 162.2
[M+CH3COO]- 242.11462 184.9
[M+Na-2H]- 204.07544 146.1
[M]+ 183.10022 141.9
[M]- 183.10132 141.9
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

No patent data available for this compound.