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]+ 192.10192 139.1
[M+Na]+ 214.08386 149.4
[M-H]- 190.08736 141.8
[M+NH4]+ 209.12846 160.2
[M+K]+ 230.05780 146.2
[M+H-H2O]+ 174.09190 133.1
[M+HCOO]- 236.09284 162.8
[M+CH3COO]- 250.10849 180.8
[M+Na-2H]- 212.06931 146.0
[M]+ 191.09409 143.0
[M]- 191.09519 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.