CID 3049151

64511-68-8

Structural Information

Molecular Formula
C20H26N2O2
SMILES
C1CN(CCC1C2=CC=CC=C2)CC(COC3=CC=C(C=C3)N)O
InChI
InChI=1S/C20H26N2O2/c21-18-6-8-20(9-7-18)24-15-19(23)14-22-12-10-17(11-13-22)16-4-2-1-3-5-16/h1-9,17,19,23H,10-15,21H2
InChIKey
JJJUFGRXAFOMMB-UHFFFAOYSA-N
Compound name
1-(4-aminophenoxy)-3-(4-phenylpiperidin-1-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.19943 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.206706 179.4
[M+Na]+ 349.188648 181.6
[M-H]- 325.192154 184.3
[M+NH4]+ 344.233253 189.8
[M+K]+ 365.162588 176.5
[M+H-H2O]+ 309.196690 169.1
[M+HCOO]- 371.197631 195.6
[M+CH3COO]- 385.213281 208.7
[M+Na-2H]- 347.174096 180.2
[M]+ 326.19888142 173.5
[M]- 326.19997858 173.5
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.