CID 397

Indole-3-acetamide

Structural Information

Molecular Formula

C₁₀H₁₀N₂O

SMILES

C1=CC=C2C(=C1)C(=CN2)CC(=O)N

InChI

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

InChIKey

ZOAMBXDOGPRZLP-UHFFFAOYSA-N

Compound name

2-(1H-indol-3-yl)acetamide

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 133
References: 2614
Patents: 174.07932 Da
Monoisotopic Mass: 0.8
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	135.3
[M+Na]+	197.06854	147.1
[M+NH4]+	192.11314	143.6
[M+K]+	213.04248	143.0
[M-H]-	173.07204	136.9
[M+Na-2H]-	195.05399	141.3
[M]+	174.07877	137.2
[M]-	174.07987	137.2

Literature stripe

literature stripe

Patent stripe

patents stripe