CID 68801158

4-(pyridin-3-ylmethyl)piperidin-4-ol dihydrochloride

Structural Information

Molecular Formula
C11H16N2O
SMILES
C1CNCCC1(CC2=CN=CC=C2)O
InChI
InChI=1S/C11H16N2O/c14-11(3-6-12-7-4-11)8-10-2-1-5-13-9-10/h1-2,5,9,12,14H,3-4,6-8H2
InChIKey
XXFNNXIQLNFXQZ-UHFFFAOYSA-N
Compound name
4-(pyridin-3-ylmethyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

192.12627 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.13355 144.9
[M+Na]+ 215.11549 149.8
[M-H]- 191.11899 145.2
[M+NH4]+ 210.16009 161.6
[M+K]+ 231.08943 146.0
[M+H-H2O]+ 175.12353 137.0
[M+HCOO]- 237.12447 160.5
[M+CH3COO]- 251.14012 155.2
[M+Na-2H]- 213.10094 151.6
[M]+ 192.12572 137.6
[M]- 192.12682 137.6
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