CID 3060395

4-benzyl-1-methyl-4-phenoxypiperidine

Structural Information

Molecular Formula
C19H23NO
SMILES
CN1CCC(CC1)(CC2=CC=CC=C2)OC3=CC=CC=C3
InChI
InChI=1S/C19H23NO/c1-20-14-12-19(13-15-20,16-17-8-4-2-5-9-17)21-18-10-6-3-7-11-18/h2-11H,12-16H2,1H3
InChIKey
PGWLLLFCIFTDDL-UHFFFAOYSA-N
Compound name
4-benzyl-1-methyl-4-phenoxypiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

281.17798 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.18526 170.2
[M+Na]+ 304.16720 185.3
[M+NH4]+ 299.21180 181.2
[M+K]+ 320.14114 173.6
[M-H]- 280.17070 177.2
[M+Na-2H]- 302.15265 182.4
[M]+ 281.17743 174.7
[M]- 281.17853 174.7
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

patents stripe