CID 10797395

1-(3-methyl-4-pyridinyl)piperazine

Structural Information

Molecular Formula
C10H15N3
SMILES
CC1=C(C=CN=C1)N2CCNCC2
InChI
InChI=1S/C10H15N3/c1-9-8-12-3-2-10(9)13-6-4-11-5-7-13/h2-3,8,11H,4-7H2,1H3
InChIKey
QIELQJJSSZTEJW-UHFFFAOYSA-N
Compound name
1-(3-methyl-4-pyridinyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

214
Patents

177.1266 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.133876 141.4
[M+Na]+ 200.115818 147.2
[M-H]- 176.119324 141.7
[M+NH4]+ 195.160423 156.3
[M+K]+ 216.089758 143.4
[M+H-H2O]+ 160.123860 132.3
[M+HCOO]- 222.124801 157.2
[M+CH3COO]- 236.140451 152.0
[M+Na-2H]- 198.101266 147.4
[M]+ 177.12605142 134.8
[M]- 177.12714858 134.8
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