CID 505089

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

Structural Information

Molecular Formula
C25H24N2O3
SMILES
CCC1CN=C(O1)C(=O)CC(=O)N(CC2=CC3=CC=CC=C3C=C2)C4=CC=CC=C4
InChI
InChI=1S/C25H24N2O3/c1-2-22-16-26-25(30-22)23(28)15-24(29)27(21-10-4-3-5-11-21)17-18-12-13-19-8-6-7-9-20(19)14-18/h3-14,22H,2,15-17H2,1H3
InChIKey
NVEVJFFZSFXICK-UHFFFAOYSA-N
Compound name
3-(5-ethyl-4,5-dihydro-1,3-oxazol-2-yl)-N-(naphthalen-2-ylmethyl)-3-oxo-N-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

400.17868 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.18596 198.7
[M+Na]+ 423.16790 202.5
[M-H]- 399.17140 209.0
[M+NH4]+ 418.21250 208.7
[M+K]+ 439.14184 199.3
[M+H-H2O]+ 383.17594 188.0
[M+HCOO]- 445.17688 217.7
[M+CH3COO]- 459.19253 207.6
[M+Na-2H]- 421.15335 199.0
[M]+ 400.17813 200.6
[M]- 400.17923 200.6
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.