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]+ 193.133546 144.9
[M+Na]+ 215.115488 149.8
[M-H]- 191.118994 145.2
[M+NH4]+ 210.160093 161.6
[M+K]+ 231.089428 146.0
[M+H-H2O]+ 175.123530 137.0
[M+HCOO]- 237.124471 160.5
[M+CH3COO]- 251.140121 155.2
[M+Na-2H]- 213.100936 151.6
[M]+ 192.12572142 137.6
[M]- 192.12681858 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