CID 90271

4-(aminomethyl)-1-phenethylpiperidin-4-ol dihydrochloride

Structural Information

Molecular Formula
C14H22N2O
SMILES
C1CN(CCC1(CN)O)CCC2=CC=CC=C2
InChI
InChI=1S/C14H22N2O/c15-12-14(17)7-10-16(11-8-14)9-6-13-4-2-1-3-5-13/h1-5,17H,6-12,15H2
InChIKey
OZWUDZJANOCZLG-UHFFFAOYSA-N
Compound name
4-(aminomethyl)-1-(2-phenylethyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

234.17322 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.18050 156.9
[M+Na]+ 257.16244 167.8
[M+NH4]+ 252.20704 166.5
[M+K]+ 273.13638 158.9
[M-H]- 233.16594 160.7
[M+Na-2H]- 255.14789 165.0
[M]+ 234.17267 159.5
[M]- 234.17377 159.5
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

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