CID 3074451

4-(3-(2-methoxyphenoxy)-3-phenylpropyl)morpholine

Structural Information

Molecular Formula
C20H25NO3
SMILES
COC1=CC=CC=C1OC(CCN2CCOCC2)C3=CC=CC=C3
InChI
InChI=1S/C20H25NO3/c1-22-19-9-5-6-10-20(19)24-18(17-7-3-2-4-8-17)11-12-21-13-15-23-16-14-21/h2-10,18H,11-16H2,1H3
InChIKey
PWCKFMOMXMBDJM-UHFFFAOYSA-N
Compound name
4-[3-(2-methoxyphenoxy)-3-phenylpropyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.18344 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.190716 179.4
[M+Na]+ 350.172658 182.0
[M-H]- 326.176164 186.6
[M+NH4]+ 345.217263 189.4
[M+K]+ 366.146598 179.7
[M+H-H2O]+ 310.180700 168.6
[M+HCOO]- 372.181641 196.0
[M+CH3COO]- 386.197291 207.6
[M+Na-2H]- 348.158106 182.4
[M]+ 327.18289142 178.4
[M]- 327.18398858 178.4
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.