CID 10130595

1909309-46-1

Structural Information

Molecular Formula

C₁₂H₂₆N₂O

SMILES

CC(CO)C1CCN(CC1)CCCCN

InChI

InChI=1S/C12H26N2O/c1-11(10-15)12-4-8-14(9-5-12)7-3-2-6-13/h11-12,15H,2-10,13H2,1H3

InChIKey

DZCRLRIXXMTCRQ-UHFFFAOYSA-N

Compound name

2-[1-(4-aminobutyl)piperidin-4-yl]propan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 214.20451 Da
Monoisotopic Mass: 0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	215.21179	154.3
[M+Na]+	237.19373	162.0
[M+NH4]+	232.23833	161.2
[M+K]+	253.16767	156.5
[M-H]-	213.19723	155.0
[M+Na-2H]-	235.17918	156.6
[M]+	214.20396	155.1
[M]-	214.20506	155.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe