CID 70888

1166-64-9

Structural Information

Molecular Formula
C20H40N4
SMILES
CN1CCC(CC1)NCC2CCC(CC2)CNC3CCN(CC3)C
InChI
InChI=1S/C20H40N4/c1-23-11-7-19(8-12-23)21-15-17-3-5-18(6-4-17)16-22-20-9-13-24(2)14-10-20/h17-22H,3-16H2,1-2H3
InChIKey
STMCRUBVLOKMKB-UHFFFAOYSA-N
Compound name
1-methyl-N-[[4-[[(1-methylpiperidin-4-yl)amino]methyl]cyclohexyl]methyl]piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.3253 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.33258 188.6
[M+Na]+ 359.31452 185.6
[M-H]- 335.31802 191.7
[M+NH4]+ 354.35912 197.8
[M+K]+ 375.28846 181.1
[M+H-H2O]+ 319.32256 176.9
[M+HCOO]- 381.32350 198.5
[M+CH3COO]- 395.33915 217.9
[M+Na-2H]- 357.29997 185.6
[M]+ 336.32475 175.0
[M]- 336.32585 175.0
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.