CID 2733992

5-amino-2-methylindole

Structural Information

Molecular Formula

C₉H₁₀N₂

SMILES

CC1=CC2=C(N1)C=CC(=C2)N

InChI

InChI=1S/C9H10N2/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-5,11H,10H2,1H3

InChIKey

JQULCCZIXYRBSE-UHFFFAOYSA-N

Compound name

2-methyl-1H-indol-5-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 821
Patents: 146.0844 Da
Monoisotopic Mass: 1.4
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]+	147.09168	127.5
[M+Na]+	169.07362	140.7
[M+NH4]+	164.11822	137.0
[M+K]+	185.04756	135.8
[M-H]-	145.07712	130.1
[M+Na-2H]-	167.05907	134.5
[M]+	146.08385	130.0
[M]-	146.08495	130.0

Literature stripe

literature stripe

Patent stripe

patents stripe