CID 18617454

1h-indole-5-ethanol

Structural Information

Molecular Formula

C₁₀H₁₁NO

SMILES

C1=CC2=C(C=CN2)C=C1CCO

InChI

InChI=1S/C10H11NO/c12-6-4-8-1-2-10-9(7-8)3-5-11-10/h1-3,5,7,11-12H,4,6H2

InChIKey

GANLUIKBHJYUBU-UHFFFAOYSA-N

Compound name

2-(1H-indol-5-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 50
Patents: 161.08406 Da
Monoisotopic Mass: 1.9
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]+	162.09134	132.2
[M+Na]+	184.07328	145.5
[M+NH4]+	179.11788	141.3
[M+K]+	200.04722	140.2
[M-H]-	160.07678	133.7
[M+Na-2H]-	182.05873	138.9
[M]+	161.08351	134.4
[M]-	161.08461	134.4

Literature stripe

literature stripe

Patent stripe

patents stripe