CID 62020093

2-{1-[(pyridin-3-yl)methyl]piperidin-2-yl}ethan-1-ol

Structural Information

Molecular Formula
C13H20N2O
SMILES
C1CCN(C(C1)CCO)CC2=CN=CC=C2
InChI
InChI=1S/C13H20N2O/c16-9-6-13-5-1-2-8-15(13)11-12-4-3-7-14-10-12/h3-4,7,10,13,16H,1-2,5-6,8-9,11H2
InChIKey
GNJZXQZDIAPBEM-UHFFFAOYSA-N
Compound name
2-[1-(pyridin-3-ylmethyl)piperidin-2-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.15756 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.16484 152.8
[M+Na]+ 243.14678 157.1
[M-H]- 219.15028 154.0
[M+NH4]+ 238.19138 167.3
[M+K]+ 259.12072 153.4
[M+H-H2O]+ 203.15482 143.8
[M+HCOO]- 265.15576 169.2
[M+CH3COO]- 279.17141 185.9
[M+Na-2H]- 241.13223 157.2
[M]+ 220.15701 148.1
[M]- 220.15811 148.1
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

No patent data available for this compound.