CID 19998

4075-79-0

Structural Information

Molecular Formula

C₁₄H₁₃NO

SMILES

CC(=O)NC1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C14H13NO/c1-11(16)15-14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-10H,1H3,(H,15,16)

InChIKey

SVLDILRDQOVJED-UHFFFAOYSA-N

Compound name

N-(4-phenylphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 15
References: 249
Patents: 211.09972 Da
Monoisotopic Mass: 3.0
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]+	212.106996	146.2
[M+Na]+	234.088938	153.0
[M-H]-	210.092444	153.1
[M+NH4]+	229.133543	164.5
[M+K]+	250.062878	149.5
[M+H-H2O]+	194.096980	138.9
[M+HCOO]-	256.097921	171.2
[M+CH3COO]-	270.113571	189.4
[M+Na-2H]-	232.074386	152.8
[M]+	211.09917142	145.0
[M]-	211.10026858	145.0

Literature stripe

literature stripe

Patent stripe

patents stripe