CID 42797

Maleimide, n-4-biphenylyl-

Structural Information

Molecular Formula

C₁₆H₁₁NO₂

SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)N3C(=O)C=CC3=O

InChI

InChI=1S/C16H11NO2/c18-15-10-11-16(19)17(15)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H

InChIKey

RXWKCYQPTDVVSI-UHFFFAOYSA-N

Compound name

1-(4-phenylphenyl)pyrrole-2,5-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 26
Patents: 249.07898 Da
Monoisotopic Mass: 2.7
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]+	250.08626	156.3
[M+Na]+	272.06820	171.9
[M+NH4]+	267.11280	165.0
[M+K]+	288.04214	165.4
[M-H]-	248.07170	161.9
[M+Na-2H]-	270.05365	166.6
[M]+	249.07843	160.1
[M]-	249.07953	160.1

Literature stripe

literature stripe

Patent stripe

patents stripe