CID 707194

3-(2-(2-pyridyl)ethyl)indole

Structural Information

Molecular Formula

C₁₅H₁₄N₂

SMILES

C1=CC=C2C(=C1)C(=CN2)CCC3=CC=CC=N3

InChI

InChI=1S/C15H14N2/c1-2-7-15-14(6-1)12(11-17-15)8-9-13-5-3-4-10-16-13/h1-7,10-11,17H,8-9H2

InChIKey

QZDNFPFFBXHYNR-UHFFFAOYSA-N

Compound name

3-(2-pyridin-2-ylethyl)-1H-indole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 19
Patents: 222.11569 Da
Monoisotopic Mass: 3.4
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]+	223.12297	150.0
[M+Na]+	245.10491	166.1
[M+NH4]+	240.14951	159.5
[M+K]+	261.07885	158.6
[M-H]-	221.10841	154.3
[M+Na-2H]-	243.09036	160.1
[M]+	222.11514	153.7
[M]-	222.11624	153.7

Literature stripe

literature stripe

Patent stripe

patents stripe