CID 3051915

4-morpholinepropanamide, n-(3,4,5-trimethoxyphenyl)-

Structural Information

Molecular Formula
C16H24N2O5
SMILES
COC1=CC(=CC(=C1OC)OC)NC(=O)CCN2CCOCC2
InChI
InChI=1S/C16H24N2O5/c1-20-13-10-12(11-14(21-2)16(13)22-3)17-15(19)4-5-18-6-8-23-9-7-18/h10-11H,4-9H2,1-3H3,(H,17,19)
InChIKey
AHVXEUDFRLKIAW-UHFFFAOYSA-N
Compound name
3-morpholin-4-yl-N-(3,4,5-trimethoxyphenyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.16852 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.17580 176.4
[M+Na]+ 347.15774 180.5
[M-H]- 323.16124 181.5
[M+NH4]+ 342.20234 187.2
[M+K]+ 363.13168 180.5
[M+H-H2O]+ 307.16578 167.0
[M+HCOO]- 369.16672 194.7
[M+CH3COO]- 383.18237 210.2
[M+Na-2H]- 345.14319 178.5
[M]+ 324.16797 179.2
[M]- 324.16907 179.2
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.