CID 809046

Morpholine, 4-((4-methoxyphenoxy)acetyl)-

Structural Information

Molecular Formula
C13H17NO4
SMILES
COC1=CC=C(C=C1)OCC(=O)N2CCOCC2
InChI
InChI=1S/C13H17NO4/c1-16-11-2-4-12(5-3-11)18-10-13(15)14-6-8-17-9-7-14/h2-5H,6-10H2,1H3
InChIKey
DLBMNRYKMGJMGK-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenoxy)-1-morpholin-4-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

0
Patents

251.11575 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.123026 155.9
[M+Na]+ 274.104968 160.7
[M-H]- 250.108474 160.9
[M+NH4]+ 269.149573 169.7
[M+K]+ 290.078908 160.6
[M+H-H2O]+ 234.113010 147.3
[M+HCOO]- 296.113951 174.1
[M+CH3COO]- 310.129601 191.5
[M+Na-2H]- 272.090416 160.5
[M]+ 251.11520142 156.2
[M]- 251.11629858 156.2
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.