CID 3060396

4-phenoxy-4-phenylpiperidine

Structural Information

Molecular Formula
C17H19NO
SMILES
C1CNCCC1(C2=CC=CC=C2)OC3=CC=CC=C3
InChI
InChI=1S/C17H19NO/c1-3-7-15(8-4-1)17(11-13-18-14-12-17)19-16-9-5-2-6-10-16/h1-10,18H,11-14H2
InChIKey
ALCIIWWYMHVLJY-UHFFFAOYSA-N
Compound name
4-phenoxy-4-phenylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

253.14667 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.153946 160.6
[M+Na]+ 276.135888 164.7
[M-H]- 252.139394 166.3
[M+NH4]+ 271.180493 176.3
[M+K]+ 292.109828 159.7
[M+H-H2O]+ 236.143930 151.1
[M+HCOO]- 298.144871 178.4
[M+CH3COO]- 312.160521 170.6
[M+Na-2H]- 274.121336 166.9
[M]+ 253.14612142 154.0
[M]- 253.14721858 154.0
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