CID 30953

3-(2-aminoethyl)-5-methoxybenzofuran, hydrochloride

Structural Information

Molecular Formula
C11H13NO2
SMILES
COC1=CC2=C(C=C1)OC=C2CCN
InChI
InChI=1S/C11H13NO2/c1-13-9-2-3-11-10(6-9)8(4-5-12)7-14-11/h2-3,6-7H,4-5,12H2,1H3
InChIKey
VGTWJKMPGQFFGR-UHFFFAOYSA-N
Compound name
2-(5-methoxy-1-benzofuran-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

191.09464 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.10192 138.7
[M+Na]+ 214.08386 151.8
[M+NH4]+ 209.12846 147.8
[M+K]+ 230.05780 147.2
[M-H]- 190.08736 143.0
[M+Na-2H]- 212.06931 144.8
[M]+ 191.09409 141.8
[M]- 191.09519 141.8
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

patents stripe