CID 34145

28089-06-7

Structural Information

Molecular Formula
C11H13NO2
SMILES
COC1=C(C=C2C(=C1)C=CO2)CCN
InChI
InChI=1S/C11H13NO2/c1-13-10-6-9-3-5-14-11(9)7-8(10)2-4-12/h3,5-7H,2,4,12H2,1H3
InChIKey
ONIATQZGIBBLJU-UHFFFAOYSA-N
Compound name
2-(5-methoxy-1-benzofuran-6-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

191.09464 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.101916 138.7
[M+Na]+ 214.083858 148.7
[M-H]- 190.087364 144.3
[M+NH4]+ 209.128463 160.0
[M+K]+ 230.057798 147.0
[M+H-H2O]+ 174.091900 133.2
[M+HCOO]- 236.092841 164.7
[M+CH3COO]- 250.108491 184.9
[M+Na-2H]- 212.069306 146.4
[M]+ 191.09409142 142.9
[M]- 191.09518858 142.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.