CID 12655251

2-(indolin-3-yl)ethanamine

Structural Information

Molecular Formula

C₁₀H₁₄N₂

SMILES

C1C(C2=CC=CC=C2N1)CCN

InChI

InChI=1S/C10H14N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,8,12H,5-7,11H2

InChIKey

ZIMNJHFFARFXNK-UHFFFAOYSA-N

Compound name

2-(2,3-dihydro-1H-indol-3-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 38
Patents: 162.11569 Da
Monoisotopic Mass: 1.1
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]+	163.12297	134.9
[M+Na]+	185.10491	145.7
[M+NH4]+	180.14951	144.1
[M+K]+	201.07885	140.7
[M-H]-	161.10841	137.0
[M+Na-2H]-	183.09036	140.1
[M]+	162.11514	136.8
[M]-	162.11624	136.8

Literature stripe

literature stripe

Patent stripe

patents stripe