CID 21192613

2-(pyridin-4-yl)piperazine

Structural Information

Molecular Formula
C9H13N3
SMILES
C1CNC(CN1)C2=CC=NC=C2
InChI
InChI=1S/C9H13N3/c1-3-10-4-2-8(1)9-7-11-5-6-12-9/h1-4,9,11-12H,5-7H2
InChIKey
QXMBJNMNHCGVDT-UHFFFAOYSA-N
Compound name
2-pyridin-4-ylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

129
Patents

163.11095 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.11823 137.1
[M+Na]+ 186.10017 142.0
[M-H]- 162.10367 135.8
[M+NH4]+ 181.14477 151.5
[M+K]+ 202.07411 137.5
[M+H-H2O]+ 146.10821 128.3
[M+HCOO]- 208.10915 151.7
[M+CH3COO]- 222.12480 147.1
[M+Na-2H]- 184.08562 143.9
[M]+ 163.11040 127.9
[M]- 163.11150 127.9
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