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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.21179 155.8
[M+Na]+ 237.19373 158.2
[M-H]- 213.19723 154.6
[M+NH4]+ 232.23833 171.8
[M+K]+ 253.16767 155.8
[M+H-H2O]+ 197.20177 148.7
[M+HCOO]- 259.20271 171.8
[M+CH3COO]- 273.21836 189.8
[M+Na-2H]- 235.17918 156.2
[M]+ 214.20396 150.5
[M]- 214.20506 150.5
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