CID 20364580

4-[(3-methoxyphenyl)methyl]piperidin-4-ol hydrochloride

Structural Information

Molecular Formula
C13H19NO2
SMILES
COC1=CC=CC(=C1)CC2(CCNCC2)O
InChI
InChI=1S/C13H19NO2/c1-16-12-4-2-3-11(9-12)10-13(15)5-7-14-8-6-13/h2-4,9,14-15H,5-8,10H2,1H3
InChIKey
HXNKGHJXINBQKN-UHFFFAOYSA-N
Compound name
4-[(3-methoxyphenyl)methyl]piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

221.14159 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.148866 152.1
[M+Na]+ 244.130808 157.1
[M-H]- 220.134314 154.0
[M+NH4]+ 239.175413 169.3
[M+K]+ 260.104748 153.5
[M+H-H2O]+ 204.138850 145.0
[M+HCOO]- 266.139791 168.7
[M+CH3COO]- 280.155441 182.3
[M+Na-2H]- 242.116256 157.2
[M]+ 221.14104142 146.9
[M]- 221.14213858 146.9
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