CID 212368

2-oxazolepropanamide, 4,5-diphenyl-

Structural Information

Molecular Formula
C18H16N2O2
SMILES
C1=CC=C(C=C1)C2=C(OC(=N2)CCC(=O)N)C3=CC=CC=C3
InChI
InChI=1S/C18H16N2O2/c19-15(21)11-12-16-20-17(13-7-3-1-4-8-13)18(22-16)14-9-5-2-6-10-14/h1-10H,11-12H2,(H2,19,21)
InChIKey
GFJOQNDSJLCSNM-UHFFFAOYSA-N
Compound name
3-(4,5-diphenyl-1,3-oxazol-2-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

292.1212 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.12848 168.4
[M+Na]+ 315.11042 175.4
[M-H]- 291.11392 177.2
[M+NH4]+ 310.15502 181.8
[M+K]+ 331.08436 171.5
[M+H-H2O]+ 275.11846 159.2
[M+HCOO]- 337.11940 191.3
[M+CH3COO]- 351.13505 180.0
[M+Na-2H]- 313.09587 171.5
[M]+ 292.12065 168.7
[M]- 292.12175 168.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe