CID 63123006

1-methyl-4-[(4-methylpiperidin-4-yl)methyl]piperazine

Structural Information

Molecular Formula
C12H25N3
SMILES
CC1(CCNCC1)CN2CCN(CC2)C
InChI
InChI=1S/C12H25N3/c1-12(3-5-13-6-4-12)11-15-9-7-14(2)8-10-15/h13H,3-11H2,1-2H3
InChIKey
KDXHYRMKXQQFNG-UHFFFAOYSA-N
Compound name
1-methyl-4-[(4-methylpiperidin-4-yl)methyl]piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.20485 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.21213 155.9
[M+Na]+ 234.19407 158.6
[M-H]- 210.19757 155.1
[M+NH4]+ 229.23867 171.2
[M+K]+ 250.16801 155.6
[M+H-H2O]+ 194.20211 146.7
[M+HCOO]- 256.20305 166.7
[M+CH3COO]- 270.21870 184.5
[M+Na-2H]- 232.17952 158.4
[M]+ 211.20430 145.9
[M]- 211.20540 145.9
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

No patent data available for this compound.