CID 6861

1-naphthaleneacetamide

Structural Information

Molecular Formula

C₁₂H₁₁NO

SMILES

C1=CC=C2C(=C1)C=CC=C2CC(=O)N

InChI

InChI=1S/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)

InChIKey

XFNJVKMNNVCYEK-UHFFFAOYSA-N

Compound name

2-naphthalen-1-ylacetamide

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 17
References: 7934
Patents: 185.08406 Da
Monoisotopic Mass: 2.1
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	138.8
[M+Na]+	208.07328	152.3
[M+NH4]+	203.11788	148.3
[M+K]+	224.04722	144.9
[M-H]-	184.07678	142.5
[M+Na-2H]-	206.05873	146.5
[M]+	185.08351	141.7
[M]-	185.08461	141.7

Literature stripe

literature stripe

Patent stripe

patents stripe