CID 66545191

1-(4-chloro-6-methylpyridin-2-yl)piperazine

Structural Information

Molecular Formula
C10H14ClN3
SMILES
CC1=CC(=CC(=N1)N2CCNCC2)Cl
InChI
InChI=1S/C10H14ClN3/c1-8-6-9(11)7-10(13-8)14-4-2-12-3-5-14/h6-7,12H,2-5H2,1H3
InChIKey
QVZOHBHYRUUDBX-UHFFFAOYSA-N
Compound name
1-(4-chloro-6-methylpyridin-2-yl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.08763 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.09491 147.0
[M+Na]+ 234.07685 154.4
[M-H]- 210.08035 147.4
[M+NH4]+ 229.12145 161.7
[M+K]+ 250.05079 149.0
[M+H-H2O]+ 194.08489 138.4
[M+HCOO]- 256.08583 158.1
[M+CH3COO]- 270.10148 157.5
[M+Na-2H]- 232.06230 151.7
[M]+ 211.08708 142.6
[M]- 211.08818 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.