CID 212606

2-piperidinoethoxydiphenyl ether hydrochloride

Structural Information

Molecular Formula
C19H23NO2
SMILES
C1CCN(CC1)CCOC2=CC=CC=C2OC3=CC=CC=C3
InChI
InChI=1S/C19H23NO2/c1-3-9-17(10-4-1)22-19-12-6-5-11-18(19)21-16-15-20-13-7-2-8-14-20/h1,3-6,9-12H,2,7-8,13-16H2
InChIKey
NEBDGPQFDFLLGT-UHFFFAOYSA-N
Compound name
1-[2-(2-phenoxyphenoxy)ethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.17288 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.18016 171.3
[M+Na]+ 320.16210 174.6
[M-H]- 296.16560 177.9
[M+NH4]+ 315.20670 183.9
[M+K]+ 336.13604 170.3
[M+H-H2O]+ 280.17014 160.7
[M+HCOO]- 342.17108 189.9
[M+CH3COO]- 356.18673 180.8
[M+Na-2H]- 318.14755 175.3
[M]+ 297.17233 168.5
[M]- 297.17343 168.5
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.