CID 45078948

1-methyl-1h-indol-7-amine

Structural Information

Molecular Formula

C₉H₁₀N₂

SMILES

CN1C=CC2=C1C(=CC=C2)N

InChI

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

InChIKey

HDRIGWFONQYMGI-UHFFFAOYSA-N

Compound name

1-methylindol-7-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 49
Patents: 146.0844 Da
Monoisotopic Mass: 1.3
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	127.1
[M+Na]+	169.07362	141.0
[M+NH4]+	164.11822	137.0
[M+K]+	185.04756	135.7
[M-H]-	145.07712	130.3
[M+Na-2H]-	167.05907	134.8
[M]+	146.08385	130.0
[M]-	146.08495	130.0

Literature stripe

literature stripe

Patent stripe

patents stripe