CID 3049305

64646-90-8

Structural Information

Molecular Formula
C16H23NO2
SMILES
C1CCN(CC1)C2CCCOC2OC3=CC=CC=C3
InChI
InChI=1S/C16H23NO2/c1-3-8-14(9-4-1)19-16-15(10-7-13-18-16)17-11-5-2-6-12-17/h1,3-4,8-9,15-16H,2,5-7,10-13H2
InChIKey
APAMQUCUKNWYCQ-UHFFFAOYSA-N
Compound name
1-(2-phenoxyoxan-3-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.17288 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.18016 164.1
[M+Na]+ 284.16210 176.7
[M+NH4]+ 279.20670 173.2
[M+K]+ 300.13604 168.9
[M-H]- 260.16560 171.4
[M+Na-2H]- 282.14755 171.9
[M]+ 261.17233 167.9
[M]- 261.17343 167.9
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.