CID 24976852

3-ethoxy-6-methoxy-1h-indole

Structural Information

Molecular Formula
C11H13NO2
SMILES
CCOC1=CNC2=C1C=CC(=C2)OC
InChI
InChI=1S/C11H13NO2/c1-3-14-11-7-12-10-6-8(13-2)4-5-9(10)11/h4-7,12H,3H2,1-2H3
InChIKey
DBYMFYZUSNSMKO-UHFFFAOYSA-N
Compound name
3-ethoxy-6-methoxy-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.09464 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.101916 139.1
[M+Na]+ 214.083858 149.4
[M-H]- 190.087364 141.8
[M+NH4]+ 209.128463 160.2
[M+K]+ 230.057798 146.2
[M+H-H2O]+ 174.091900 133.1
[M+HCOO]- 236.092841 162.8
[M+CH3COO]- 250.108491 180.8
[M+Na-2H]- 212.069306 146.0
[M]+ 191.09409142 143.0
[M]- 191.09518858 143.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.