CID 3075555

185759-13-1

Structural Information

Molecular Formula
C18H26N2O3
SMILES
C1CCN(CC1)C(=O)OCCN2CCOC(C2)C3=CC=CC=C3
InChI
InChI=1S/C18H26N2O3/c21-18(20-9-5-2-6-10-20)23-14-12-19-11-13-22-17(15-19)16-7-3-1-4-8-16/h1,3-4,7-8,17H,2,5-6,9-15H2
InChIKey
XDFHAXKJRHSYFZ-UHFFFAOYSA-N
Compound name
2-(2-phenylmorpholin-4-yl)ethyl piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.19434 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.20162 178.1
[M+Na]+ 341.18356 178.9
[M-H]- 317.18706 183.1
[M+NH4]+ 336.22816 186.9
[M+K]+ 357.15750 176.8
[M+H-H2O]+ 301.19160 166.7
[M+HCOO]- 363.19254 189.9
[M+CH3COO]- 377.20819 203.6
[M+Na-2H]- 339.16901 179.0
[M]+ 318.19379 171.9
[M]- 318.19489 171.9
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.