CID 23346

N,n'-benzylidenebisacetamide

Structural Information

Molecular Formula

C₁₁H₁₄N₂O₂

SMILES

CC(=O)NC(C1=CC=CC=C1)NC(=O)C

InChI

InChI=1S/C11H14N2O2/c1-8(14)12-11(13-9(2)15)10-6-4-3-5-7-10/h3-7,11H,1-2H3,(H,12,14)(H,13,15)

InChIKey

JFUUKHUKGAQKIW-UHFFFAOYSA-N

Compound name

N-[acetamido(phenyl)methyl]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 3
Patents: 206.10553 Da
Monoisotopic Mass: 0.5
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]+	207.11281	146.9
[M+Na]+	229.09475	151.5
[M-H]-	205.09825	150.3
[M+NH4]+	224.13935	164.8
[M+K]+	245.06869	150.4
[M+H-H2O]+	189.10279	140.1
[M+HCOO]-	251.10373	170.7
[M+CH3COO]-	265.11938	190.8
[M+Na-2H]-	227.08020	150.8
[M]+	206.10498	145.4
[M]-	206.10608	145.4

Literature stripe

literature stripe

Patent stripe

patents stripe