CID 3065078

106609-38-5

Structural Information

Molecular Formula
C19H23NO2
SMILES
COC1=CC=C(C=C1)C2=CC(=C(C=C2)O)CN3CCCCC3
InChI
InChI=1S/C19H23NO2/c1-22-18-8-5-15(6-9-18)16-7-10-19(21)17(13-16)14-20-11-3-2-4-12-20/h5-10,13,21H,2-4,11-12,14H2,1H3
InChIKey
PVVOPOVVCWHQKK-UHFFFAOYSA-N
Compound name
4-(4-methoxyphenyl)-2-(piperidin-1-ylmethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.17288 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.18016 171.9
[M+Na]+ 320.16210 176.7
[M-H]- 296.16560 178.0
[M+NH4]+ 315.20670 184.5
[M+K]+ 336.13604 171.7
[M+H-H2O]+ 280.17014 162.1
[M+HCOO]- 342.17108 189.1
[M+CH3COO]- 356.18673 181.5
[M+Na-2H]- 318.14755 174.0
[M]+ 297.17233 168.3
[M]- 297.17343 168.3
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.