CID 45599154

(3-methoxyphenyl)(piperidin-4-yl)methanol hydrochloride

Structural Information

Molecular Formula
C13H19NO2
SMILES
COC1=CC=CC(=C1)C(C2CCNCC2)O
InChI
InChI=1S/C13H19NO2/c1-16-12-4-2-3-11(9-12)13(15)10-5-7-14-8-6-10/h2-4,9-10,13-15H,5-8H2,1H3
InChIKey
XILQNTZEDHMQDT-UHFFFAOYSA-N
Compound name
(3-methoxyphenyl)-piperidin-4-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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 151.8
[M+Na]+ 244.13081 155.4
[M-H]- 220.13431 153.3
[M+NH4]+ 239.17541 166.8
[M+K]+ 260.10475 152.0
[M+H-H2O]+ 204.13885 144.2
[M+HCOO]- 266.13979 167.2
[M+CH3COO]- 280.15544 183.6
[M+Na-2H]- 242.11626 154.5
[M]+ 221.14104 145.6
[M]- 221.14214 145.6
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

No patent data available for this compound.