CID 505083

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

Structural Information

Molecular Formula
C23H26N2O3
SMILES
C1COC(=N1)C(=O)CC(=O)N(CCCC2=CC=CC=C2)CCC3=CC=CC=C3
InChI
InChI=1S/C23H26N2O3/c26-21(23-24-14-17-28-23)18-22(27)25(16-13-20-10-5-2-6-11-20)15-7-12-19-8-3-1-4-9-19/h1-6,8-11H,7,12-18H2
InChIKey
YCGVIOZNTYEOED-UHFFFAOYSA-N
Compound name
3-(4,5-dihydro-1,3-oxazol-2-yl)-3-oxo-N-(2-phenylethyl)-N-(3-phenylpropyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

378.19434 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.20162 194.3
[M+Na]+ 401.18356 196.1
[M-H]- 377.18706 203.1
[M+NH4]+ 396.22816 204.0
[M+K]+ 417.15750 193.6
[M+H-H2O]+ 361.19160 183.5
[M+HCOO]- 423.19254 214.5
[M+CH3COO]- 437.20819 221.3
[M+Na-2H]- 399.16901 194.3
[M]+ 378.19379 196.2
[M]- 378.19489 196.2
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.