CID 10774598

180624-24-2

Structural Information

Molecular Formula

C₁₁H₁₁NO₃

SMILES

COC1=C2C(=CC(=C1)C(=O)OC)C=CN2

InChI

InChI=1S/C11H11NO3/c1-14-9-6-8(11(13)15-2)5-7-3-4-12-10(7)9/h3-6,12H,1-2H3

InChIKey

MLHFMFQDMLBLID-UHFFFAOYSA-N

Compound name

methyl 7-methoxy-1H-indole-5-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 205.0739 Da
Monoisotopic Mass: 1.9
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]+	206.08118	142.3
[M+Na]+	228.06312	155.0
[M+NH4]+	223.10772	149.9
[M+K]+	244.03706	151.2
[M-H]-	204.06662	142.8
[M+Na-2H]-	226.04857	147.6
[M]+	205.07335	144.1
[M]-	205.07445	144.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe