CID 28063460

1-(2,6-dimethylpyridin-4-yl)piperazine dihydrochloride

Structural Information

Molecular Formula
C11H17N3
SMILES
CC1=CC(=CC(=N1)C)N2CCNCC2
InChI
InChI=1S/C11H17N3/c1-9-7-11(8-10(2)13-9)14-5-3-12-4-6-14/h7-8,12H,3-6H2,1-2H3
InChIKey
BCANMDDAARPKKQ-UHFFFAOYSA-N
Compound name
1-(2,6-dimethyl-4-pyridinyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

191.14224 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.149516 146.2
[M+Na]+ 214.131458 152.6
[M-H]- 190.134964 146.8
[M+NH4]+ 209.176063 160.9
[M+K]+ 230.105398 148.5
[M+H-H2O]+ 174.139500 137.2
[M+HCOO]- 236.140441 161.7
[M+CH3COO]- 250.156091 156.8
[M+Na-2H]- 212.116906 150.8
[M]+ 191.14169142 140.3
[M]- 191.14278858 140.3
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