CID 3086840

Beta-morpholino-p-octanophenetidide

Structural Information

Molecular Formula
C20H32N2O3
SMILES
CCCCCC(CC(=O)NC1=CC=C(C=C1)OCC)N2CCOCC2
InChI
InChI=1S/C20H32N2O3/c1-3-5-6-7-18(22-12-14-24-15-13-22)16-20(23)21-17-8-10-19(11-9-17)25-4-2/h8-11,18H,3-7,12-16H2,1-2H3,(H,21,23)
InChIKey
YPMQBESFLBUXMB-UHFFFAOYSA-N
Compound name
N-(4-ethoxyphenyl)-3-morpholin-4-yloctanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.2413 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.24858 189.4
[M+Na]+ 371.23052 189.9
[M-H]- 347.23402 193.0
[M+NH4]+ 366.27512 198.7
[M+K]+ 387.20446 188.1
[M+H-H2O]+ 331.23856 179.2
[M+HCOO]- 393.23950 204.9
[M+CH3COO]- 407.25515 216.1
[M+Na-2H]- 369.21597 189.3
[M]+ 348.24075 189.2
[M]- 348.24185 189.2
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.