CID 15626107

4,5-dichloro-2,6-dimethylpyrimidine

Structural Information

Molecular Formula
C6H6Cl2N2
SMILES
CC1=C(C(=NC(=N1)C)Cl)Cl
InChI
InChI=1S/C6H6Cl2N2/c1-3-5(7)6(8)10-4(2)9-3/h1-2H3
InChIKey
GCOLCOMAZNJNON-UHFFFAOYSA-N
Compound name
4,5-dichloro-2,6-dimethylpyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

175.9908 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.998076 128.9
[M+Na]+ 198.980018 141.3
[M-H]- 174.983524 129.8
[M+NH4]+ 194.024623 148.4
[M+K]+ 214.953958 136.8
[M+H-H2O]+ 158.988060 123.7
[M+HCOO]- 220.989001 141.8
[M+CH3COO]- 235.004651 179.8
[M+Na-2H]- 196.965466 135.4
[M]+ 175.99025142 132.3
[M]- 175.99134858 132.3
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