CID 3021421

Morpholine, 4-benzyl-2-((2-ethoxybenzyl)oxy)-, hydrochloride

Structural Information

Molecular Formula
C20H25NO3
SMILES
CCOC1=CC=CC=C1COC2CN(CCO2)CC3=CC=CC=C3
InChI
InChI=1S/C20H25NO3/c1-2-22-19-11-7-6-10-18(19)16-24-20-15-21(12-13-23-20)14-17-8-4-3-5-9-17/h3-11,20H,2,12-16H2,1H3
InChIKey
OUCTXKQVYKZVQI-UHFFFAOYSA-N
Compound name
4-benzyl-2-[(2-ethoxyphenyl)methoxy]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.18344 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.190716 179.6
[M+Na]+ 350.172658 183.5
[M-H]- 326.176164 187.1
[M+NH4]+ 345.217263 190.0
[M+K]+ 366.146598 180.7
[M+H-H2O]+ 310.180700 168.8
[M+HCOO]- 372.181641 197.2
[M+CH3COO]- 386.197291 207.9
[M+Na-2H]- 348.158106 183.0
[M]+ 327.18289142 179.7
[M]- 327.18398858 179.7
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.