CID 458512

Cambridge id 7014650

Structural Information

Molecular Formula
C20H25NO3
SMILES
C1COCCN1CCOCCOC2=CC=CC=C2C3=CC=CC=C3
InChI
InChI=1S/C20H25NO3/c1-2-6-18(7-3-1)19-8-4-5-9-20(19)24-17-16-23-15-12-21-10-13-22-14-11-21/h1-9H,10-17H2
InChIKey
JGQUNNCRGONTTB-UHFFFAOYSA-N
Compound name
4-[2-[2-(2-phenylphenoxy)ethoxy]ethyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

327.18344 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.19072 179.1
[M+Na]+ 350.17266 181.9
[M-H]- 326.17616 186.1
[M+NH4]+ 345.21726 189.1
[M+K]+ 366.14660 179.1
[M+H-H2O]+ 310.18070 168.0
[M+HCOO]- 372.18164 196.6
[M+CH3COO]- 386.19729 206.8
[M+Na-2H]- 348.15811 183.2
[M]+ 327.18289 178.6
[M]- 327.18399 178.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.