CID 319497

Nsc263796

Structural Information

Molecular Formula

C₂₀H₁₇NO

SMILES

CC1=CC=CC=C1C(=O)NC2=CC=CC=C2C3=CC=CC=C3

InChI

InChI=1S/C20H17NO/c1-15-9-5-6-12-17(15)20(22)21-19-14-8-7-13-18(19)16-10-3-2-4-11-16/h2-14H,1H3,(H,21,22)

InChIKey

SSWNJXZKFXQOKV-UHFFFAOYSA-N

Compound name

2-methyl-N-(2-phenylphenyl)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 287.131 Da
Monoisotopic Mass: 4.0
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]+	288.13828	167.8
[M+Na]+	310.12022	174.1
[M-H]-	286.12372	177.4
[M+NH4]+	305.16482	182.5
[M+K]+	326.09416	168.6
[M+H-H2O]+	270.12826	158.6
[M+HCOO]-	332.12920	191.9
[M+CH3COO]-	346.14485	179.3
[M+Na-2H]-	308.10567	172.9
[M]+	287.13045	166.3
[M]-	287.13155	166.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe