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]+ 221.164836 152.8
[M+Na]+ 243.146778 157.1
[M-H]- 219.150284 154.0
[M+NH4]+ 238.191383 167.3
[M+K]+ 259.120718 153.4
[M+H-H2O]+ 203.154820 143.8
[M+HCOO]- 265.155761 169.2
[M+CH3COO]- 279.171411 185.9
[M+Na-2H]- 241.132226 157.2
[M]+ 220.15701142 148.1
[M]- 220.15810858 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.