CID 122376

4-chloro-2,5-diphenyloxazole

Structural Information

Molecular Formula

C₁₅H₁₀ClNO

SMILES

C1=CC=C(C=C1)C2=C(N=C(O2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C15H10ClNO/c16-14-13(11-7-3-1-4-8-11)18-15(17-14)12-9-5-2-6-10-12/h1-10H

InChIKey

FVMCUFNNIHZLNR-UHFFFAOYSA-N

Compound name

4-chloro-2,5-diphenyl-1,3-oxazole

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 4
Patents: 255.04509 Da
Monoisotopic Mass: 4.6
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]+	256.05237	155.0
[M+Na]+	278.03431	173.1
[M+NH4]+	273.07891	165.2
[M+K]+	294.00825	165.4
[M-H]-	254.03781	163.1
[M+Na-2H]-	276.01976	166.9
[M]+	255.04454	160.5
[M]-	255.04564	160.5

Literature stripe

literature stripe

Patent stripe

patents stripe