CID 21983169

N-(1-naphthyl)acrylamide

Structural Information

Molecular Formula

C₁₃H₁₁NO

SMILES

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

InChI

InChI=1S/C13H11NO/c1-2-13(15)14-12-9-5-7-10-6-3-4-8-11(10)12/h2-9H,1H2,(H,14,15)

InChIKey

MQDUBLLPBLXPNJ-UHFFFAOYSA-N

Compound name

N-naphthalen-1-ylprop-2-enamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 440
Patents: 197.08406 Da
Monoisotopic Mass: 2.2
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]+	198.09134	141.1
[M+Na]+	220.07328	148.7
[M-H]-	196.07678	145.7
[M+NH4]+	215.11788	161.2
[M+K]+	236.04722	144.8
[M+H-H2O]+	180.08132	134.8
[M+HCOO]-	242.08226	165.0
[M+CH3COO]-	256.09791	187.3
[M+Na-2H]-	218.05873	149.0
[M]+	197.08351	140.2
[M]-	197.08461	140.2

Literature stripe

literature stripe

Patent stripe

patents stripe