CID 3049159

64511-78-0

Structural Information

Molecular Formula
C20H26N2O2
SMILES
C1CN(CCC1C2=CC=CC=C2)CC(COC3=CC=CC(=C3)N)O
InChI
InChI=1S/C20H26N2O2/c21-18-7-4-8-20(13-18)24-15-19(23)14-22-11-9-17(10-12-22)16-5-2-1-3-6-16/h1-8,13,17,19,23H,9-12,14-15,21H2
InChIKey
MWLUCYRLSCOAHZ-UHFFFAOYSA-N
Compound name
1-(3-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]+ 327.20671 179.4
[M+Na]+ 349.18865 181.6
[M-H]- 325.19215 184.3
[M+NH4]+ 344.23325 189.8
[M+K]+ 365.16259 176.5
[M+H-H2O]+ 309.19669 169.1
[M+HCOO]- 371.19763 195.6
[M+CH3COO]- 385.21328 208.7
[M+Na-2H]- 347.17410 180.2
[M]+ 326.19888 173.5
[M]- 326.19998 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.