CID 151245

5014-83-5

Structural Information

Molecular Formula

C₁₅H₁₁NO₂

SMILES

C1=CC=C(C=C1)C2=C(OC(=O)N2)C3=CC=CC=C3

InChI

InChI=1S/C15H11NO2/c17-15-16-13(11-7-3-1-4-8-11)14(18-15)12-9-5-2-6-10-12/h1-10H,(H,16,17)

InChIKey

LDPBTGBWTUWCBU-UHFFFAOYSA-N

Compound name

4,5-diphenyl-3H-1,3-oxazol-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 9
References: 1454
Patents: 237.07898 Da
Monoisotopic Mass: 3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	238.086256	150.1
[M+Na]+	260.068198	159.4
[M-H]-	236.071704	158.6
[M+NH4]+	255.112803	165.9
[M+K]+	276.042138	155.2
[M+H-H2O]+	220.076240	142.2
[M+HCOO]-	282.077181	173.2
[M+CH3COO]-	296.092831	163.4
[M+Na-2H]-	258.053646	156.1
[M]+	237.07843142	149.9
[M]-	237.07952858	149.9

Literature stripe

literature stripe

Patent stripe

patents stripe