CID 22329429

1-ethyl-1h-indol-6-amine

Structural Information

Molecular Formula

C₁₀H₁₂N₂

SMILES

CCN1C=CC2=C1C=C(C=C2)N

InChI

InChI=1S/C10H12N2/c1-2-12-6-5-8-3-4-9(11)7-10(8)12/h3-7H,2,11H2,1H3

InChIKey

MDHUYIXJXAQMAP-UHFFFAOYSA-N

Compound name

1-ethylindol-6-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 42
Patents: 160.10005 Da
Monoisotopic Mass: 1.6
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]+	161.107326	131.7
[M+Na]+	183.089268	142.3
[M-H]-	159.092774	135.4
[M+NH4]+	178.133873	154.3
[M+K]+	199.063208	138.7
[M+H-H2O]+	143.097310	125.6
[M+HCOO]-	205.098251	157.3
[M+CH3COO]-	219.113901	146.4
[M+Na-2H]-	181.074716	139.1
[M]+	160.09950142	132.6
[M]-	160.10059858	132.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe