CID 62756582

N,n-dimethyl-5-[(methylamino)methyl]pyrimidin-2-amine

Structural Information

Molecular Formula
C8H14N4
SMILES
CNCC1=CN=C(N=C1)N(C)C
InChI
InChI=1S/C8H14N4/c1-9-4-7-5-10-8(11-6-7)12(2)3/h5-6,9H,4H2,1-3H3
InChIKey
DSEMCBZVWDDRJS-UHFFFAOYSA-N
Compound name
N,N-dimethyl-5-(methylaminomethyl)pyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

166.12184 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.129116 136.4
[M+Na]+ 189.111058 143.7
[M-H]- 165.114564 138.9
[M+NH4]+ 184.155663 154.6
[M+K]+ 205.084998 143.0
[M+H-H2O]+ 149.119100 128.3
[M+HCOO]- 211.120041 161.3
[M+CH3COO]- 225.135691 188.0
[M+Na-2H]- 187.096506 144.5
[M]+ 166.12129142 137.1
[M]- 166.12238858 137.1
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

patents stripe