CID 595238

4-methoxy-1-methyl-1h-indole

Structural Information

Molecular Formula

C₁₀H₁₁NO

SMILES

CN1C=CC2=C1C=CC=C2OC

InChI

InChI=1S/C10H11NO/c1-11-7-6-8-9(11)4-3-5-10(8)12-2/h3-7H,1-2H3

InChIKey

ATEWBFOJLQMYEA-UHFFFAOYSA-N

Compound name

4-methoxy-1-methylindole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 193
Patents: 161.08406 Da
Monoisotopic Mass: 2.0
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]+	162.09134	130.9
[M+Na]+	184.07328	145.7
[M+NH4]+	179.11788	140.7
[M+K]+	200.04722	140.1
[M-H]-	160.07678	133.6
[M+Na-2H]-	182.05873	138.7
[M]+	161.08351	133.9
[M]-	161.08461	133.9

Literature stripe

literature stripe

Patent stripe

patents stripe