CID 58838

Br 81

Structural Information

Molecular Formula
C19H28N2O4
SMILES
CCC(C1=CC=CC=C1)(C(=O)NCCN2CCOCC2)C(=O)OCC
InChI
InChI=1S/C19H28N2O4/c1-3-19(18(23)25-4-2,16-8-6-5-7-9-16)17(22)20-10-11-21-12-14-24-15-13-21/h5-9H,3-4,10-15H2,1-2H3,(H,20,22)
InChIKey
MRMBRFVLYMUNLE-UHFFFAOYSA-N
Compound name
ethyl 2-(2-morpholin-4-ylethylcarbamoyl)-2-phenylbutanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.2049 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.21218 184.7
[M+Na]+ 371.19412 192.8
[M+NH4]+ 366.23872 189.5
[M+K]+ 387.16806 188.4
[M-H]- 347.19762 187.1
[M+Na-2H]- 369.17957 188.5
[M]+ 348.20435 186.2
[M]- 348.20545 186.2
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.