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

24
Patents

221.14159 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.14887 152.1
[M+Na]+ 244.13081 157.1
[M-H]- 220.13431 154.0
[M+NH4]+ 239.17541 169.3
[M+K]+ 260.10475 153.5
[M+H-H2O]+ 204.13885 145.0
[M+HCOO]- 266.13979 168.7
[M+CH3COO]- 280.15544 182.3
[M+Na-2H]- 242.11626 157.2
[M]+ 221.14104 146.9
[M]- 221.14214 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