CID 24903687

4,6-dichloro-2-cyclopropylpyrimidine

Structural Information

Molecular Formula
C7H6Cl2N2
SMILES
C1CC1C2=NC(=CC(=N2)Cl)Cl
InChI
InChI=1S/C7H6Cl2N2/c8-5-3-6(9)11-7(10-5)4-1-2-4/h3-4H,1-2H2
InChIKey
YBOWZANEONZCOL-UHFFFAOYSA-N
Compound name
4,6-dichloro-2-cyclopropylpyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

86
Patents

187.9908 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.99808 133.8
[M+Na]+ 210.98002 150.8
[M+NH4]+ 206.02462 143.8
[M+K]+ 226.95396 144.3
[M-H]- 186.98352 143.2
[M+Na-2H]- 208.96547 145.1
[M]+ 187.99025 140.6
[M]- 187.99135 140.6
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