CID 5931654

15286-52-9

Structural Information

Molecular Formula

C₁₆H₁₅NO

SMILES

COC1=CC=C(C=C1)N=C/C=C/C2=CC=CC=C2

InChI

InChI=1S/C16H15NO/c1-18-16-11-9-15(10-12-16)17-13-5-8-14-6-3-2-4-7-14/h2-13H,1H3/b8-5+,17-13?

InChIKey

MBPYUPPKESSJGW-DZVXKPJGSA-N

Compound name

(E)-N-(4-methoxyphenyl)-3-phenylprop-2-en-1-imine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 13
Patents: 237.11537 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]+	238.122646	153.9
[M+Na]+	260.104588	160.9
[M-H]-	236.108094	161.7
[M+NH4]+	255.149193	171.8
[M+K]+	276.078528	156.7
[M+H-H2O]+	220.112630	145.8
[M+HCOO]-	282.113571	180.8
[M+CH3COO]-	296.129221	195.7
[M+Na-2H]-	258.090036	161.0
[M]+	237.11482142	155.0
[M]-	237.11591858	155.0

Literature stripe

literature stripe

Patent stripe

patents stripe