CID 291034

N-(3-phenyl-2-propenylidene)aniline

Structural Information

Molecular Formula

C₁₅H₁₃N

SMILES

C1=CC=C(C=C1)C=CC=NC2=CC=CC=C2

InChI

InChI=1S/C15H13N/c1-3-8-14(9-4-1)10-7-13-16-15-11-5-2-6-12-15/h1-13H

InChIKey

RGKOSCNIXIHSDE-UHFFFAOYSA-N

Compound name

N,3-diphenylprop-2-en-1-imine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 53
Patents: 207.1048 Da
Monoisotopic Mass: 3.6
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]+	208.11208	145.8
[M+Na]+	230.09402	152.4
[M-H]-	206.09752	153.4
[M+NH4]+	225.13862	164.7
[M+K]+	246.06796	147.9
[M+H-H2O]+	190.10206	138.0
[M+HCOO]-	252.10300	172.9
[M+CH3COO]-	266.11865	189.6
[M+Na-2H]-	228.07947	154.3
[M]+	207.10425	144.8
[M]-	207.10535	144.8

Literature stripe

literature stripe

Patent stripe

patents stripe