CID 3064308

Brn 0299589

Structural Information

Molecular Formula
C23H31NO
SMILES
CCC1CCN(CC1)CCCC2=CC=C(C=C2)COC3=CC=CC=C3
InChI
InChI=1S/C23H31NO/c1-2-20-14-17-24(18-15-20)16-6-7-21-10-12-22(13-11-21)19-25-23-8-4-3-5-9-23/h3-5,8-13,20H,2,6-7,14-19H2,1H3
InChIKey
FHZIEVMWIGAKJZ-UHFFFAOYSA-N
Compound name
4-ethyl-1-[3-[4-(phenoxymethyl)phenyl]propyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.24057 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.24785 187.9
[M+Na]+ 360.22979 202.3
[M+NH4]+ 355.27439 196.7
[M+K]+ 376.20373 191.6
[M-H]- 336.23329 194.8
[M+Na-2H]- 358.21524 197.3
[M]+ 337.24002 192.1
[M]- 337.24112 192.1
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.