CID 69661067

N-(1h-indol-7-yl)acetamide

Structural Information

Molecular Formula

C₁₀H₁₀N₂O

SMILES

CC(=O)NC1=CC=CC2=C1NC=C2

InChI

InChI=1S/C10H10N2O/c1-7(13)12-9-4-2-3-8-5-6-11-10(8)9/h2-6,11H,1H3,(H,12,13)

InChIKey

DCOHDTHCOCZQTO-UHFFFAOYSA-N

Compound name

N-(1H-indol-7-yl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 174.07932 Da
Monoisotopic Mass: 2.0
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]+	175.086596	134.7
[M+Na]+	197.068538	143.8
[M-H]-	173.072044	137.3
[M+NH4]+	192.113143	155.7
[M+K]+	213.042478	140.1
[M+H-H2O]+	157.076580	128.5
[M+HCOO]-	219.077521	158.8
[M+CH3COO]-	233.093171	178.8
[M+Na-2H]-	195.053986	142.1
[M]+	174.07877142	134.3
[M]-	174.07986858	134.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe