CID 68461

575-36-0

Structural Information

Molecular Formula

C₁₂H₁₁NO

SMILES

CC(=O)NC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C12H11NO/c1-9(14)13-12-8-4-6-10-5-2-3-7-11(10)12/h2-8H,1H3,(H,13,14)

InChIKey

OKQIEBVRUGLWOR-UHFFFAOYSA-N

Compound name

N-naphthalen-1-ylacetamide

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 2
References: 1015
Patents: 185.08406 Da
Monoisotopic Mass: 1.6
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]+	186.09134	137.7
[M+Na]+	208.07328	145.4
[M-H]-	184.07678	142.4
[M+NH4]+	203.11788	158.4
[M+K]+	224.04722	142.4
[M+H-H2O]+	168.08132	131.5
[M+HCOO]-	230.08226	161.7
[M+CH3COO]-	244.09791	185.1
[M+Na-2H]-	206.05873	146.1
[M]+	185.08351	137.2
[M]-	185.08461	137.2

Literature stripe

literature stripe

Patent stripe

patents stripe