CID 505085

3-(5-ethyl-4,5-dihydro-oxazol-2-yl)-n-(4-methoxy-phenyl)-3-oxo-n-(3-phenyl-propyl)-propionamide

Structural Information

Molecular Formula
C24H28N2O4
SMILES
CCC1CN=C(O1)C(=O)CC(=O)N(CCCC2=CC=CC=C2)C3=CC=C(C=C3)OC
InChI
InChI=1S/C24H28N2O4/c1-3-20-17-25-24(30-20)22(27)16-23(28)26(19-11-13-21(29-2)14-12-19)15-7-10-18-8-5-4-6-9-18/h4-6,8-9,11-14,20H,3,7,10,15-17H2,1-2H3
InChIKey
MUXUEYJPZNUWBN-UHFFFAOYSA-N
Compound name
3-(5-ethyl-4,5-dihydro-1,3-oxazol-2-yl)-N-(4-methoxyphenyl)-3-oxo-N-(3-phenylpropyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

408.2049 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.21218 201.8
[M+Na]+ 431.19412 204.7
[M-H]- 407.19762 211.2
[M+NH4]+ 426.23872 210.8
[M+K]+ 447.16806 202.9
[M+H-H2O]+ 391.20216 191.1
[M+HCOO]- 453.20310 221.8
[M+CH3COO]- 467.21875 228.8
[M+Na-2H]- 429.17957 200.0
[M]+ 408.20435 206.3
[M]- 408.20545 206.3
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.