CID 4408257

2-(1h-indol-1-yl)acetamide

Structural Information

Molecular Formula

C₁₀H₁₀N₂O

SMILES

C1=CC=C2C(=C1)C=CN2CC(=O)N

InChI

InChI=1S/C10H10N2O/c11-10(13)7-12-6-5-8-3-1-2-4-9(8)12/h1-6H,7H2,(H2,11,13)

InChIKey

IUUZMSMGSOUFTO-UHFFFAOYSA-N

Compound name

2-indol-1-ylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 8
References: 212
Patents: 174.07932 Da
Monoisotopic Mass: 1.8
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]+	175.08660	134.6
[M+Na]+	197.06854	144.0
[M-H]-	173.07204	138.0
[M+NH4]+	192.11314	156.0
[M+K]+	213.04248	140.9
[M+H-H2O]+	157.07658	128.1
[M+HCOO]-	219.07752	159.5
[M+CH3COO]-	233.09317	181.4
[M+Na-2H]-	195.05399	141.4
[M]+	174.07877	135.2
[M]-	174.07987	135.2

Literature stripe

literature stripe

Patent stripe

patents stripe