CID 165889490

1-(4-chloro-1,3,5-triazin-2-yl)-4-piperidinamine hydrochloride

Structural Information

Molecular Formula
C8H12ClN5
SMILES
C1CN(CCC1N)C2=NC(=NC=N2)Cl
InChI
InChI=1S/C8H12ClN5/c9-7-11-5-12-8(13-7)14-3-1-6(10)2-4-14/h5-6H,1-4,10H2
InChIKey
NXFXEQNLABZXGN-UHFFFAOYSA-N
Compound name
1-(4-chloro-1,3,5-triazin-2-yl)piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.07812 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.08540 147.0
[M+Na]+ 236.06734 154.9
[M-H]- 212.07084 147.0
[M+NH4]+ 231.11194 160.2
[M+K]+ 252.04128 150.0
[M+H-H2O]+ 196.07538 137.2
[M+HCOO]- 258.07632 159.2
[M+CH3COO]- 272.09197 157.4
[M+Na-2H]- 234.05279 152.6
[M]+ 213.07757 142.6
[M]- 213.07867 142.6
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

No patent data available for this compound.