CID 12331517

4,6-dichloro-n,n,5-trimethylpyrimidin-2-amine

Structural Information

Molecular Formula
C7H9Cl2N3
SMILES
CC1=C(N=C(N=C1Cl)N(C)C)Cl
InChI
InChI=1S/C7H9Cl2N3/c1-4-5(8)10-7(12(2)3)11-6(4)9/h1-3H3
InChIKey
JYFSQUKOJVZDJE-UHFFFAOYSA-N
Compound name
4,6-dichloro-N,N,5-trimethylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

205.01735 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.02463 138.5
[M+Na]+ 228.00657 149.8
[M-H]- 204.01007 140.7
[M+NH4]+ 223.05117 157.2
[M+K]+ 243.98051 146.1
[M+H-H2O]+ 188.01461 132.5
[M+HCOO]- 250.01555 152.6
[M+CH3COO]- 264.03120 190.9
[M+Na-2H]- 225.99202 144.0
[M]+ 205.01680 143.0
[M]- 205.01790 143.0
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