CID 55265487

3-cyclopentyl-1h-indole

Structural Information

Molecular Formula

C₁₃H₁₅N

SMILES

C1CCC(C1)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C13H15N/c1-2-6-10(5-1)12-9-14-13-8-4-3-7-11(12)13/h3-4,7-10,14H,1-2,5-6H2

InChIKey

CODQEEVNEGRRSZ-UHFFFAOYSA-N

Compound name

3-cyclopentyl-1H-indole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 185.12045 Da
Monoisotopic Mass: 4.2
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]+	186.12773	140.9
[M+Na]+	208.10967	153.7
[M+NH4]+	203.15427	151.2
[M+K]+	224.08361	149.3
[M-H]-	184.11317	144.9
[M+Na-2H]-	206.09512	148.4
[M]+	185.11990	143.8
[M]-	185.12100	143.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe