CID 3042071

59022-46-7

Structural Information

Molecular Formula

C₁₃H₁₆N₂O

SMILES

CCN1CCC2(C1)C3=CC=CC=C3NC2=O

InChI

InChI=1S/C13H16N2O/c1-2-15-8-7-13(9-15)10-5-3-4-6-11(10)14-12(13)16/h3-6H,2,7-9H2,1H3,(H,14,16)

InChIKey

BJKDWGHYHWIQIM-UHFFFAOYSA-N

Compound name

1'-ethylspiro[1H-indole-3,3'-pyrrolidine]-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 216.12627 Da
Monoisotopic Mass: 1.2
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]+	217.13355	150.4
[M+Na]+	239.11549	161.2
[M+NH4]+	234.16009	160.4
[M+K]+	255.08943	156.3
[M-H]-	215.11899	151.9
[M+Na-2H]-	237.10094	155.5
[M]+	216.12572	152.3
[M]-	216.12682	152.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.