CID 209165

2,4-dichloro-6-(piperidin-1-yl)-1,3,5-triazine

Structural Information

Molecular Formula
C8H10Cl2N4
SMILES
C1CCN(CC1)C2=NC(=NC(=N2)Cl)Cl
InChI
InChI=1S/C8H10Cl2N4/c9-6-11-7(10)13-8(12-6)14-4-2-1-3-5-14/h1-5H2
InChIKey
MUEJUOUFUTUSED-UHFFFAOYSA-N
Compound name
2,4-dichloro-6-piperidin-1-yl-1,3,5-triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

100
Patents

232.02826 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.03554 146.9
[M+Na]+ 255.01748 155.6
[M-H]- 231.02098 146.4
[M+NH4]+ 250.06208 160.2
[M+K]+ 270.99142 150.3
[M+H-H2O]+ 215.02552 137.2
[M+HCOO]- 277.02646 153.3
[M+CH3COO]- 291.04211 157.1
[M+Na-2H]- 253.00293 152.1
[M]+ 232.02771 144.8
[M]- 232.02881 144.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe