CID 19219

3610-35-3

Structural Information

Molecular Formula
C11H14N2O
SMILES
COC1=CC=CC2=C1C(=CN2)CCN
InChI
InChI=1S/C11H14N2O/c1-14-10-4-2-3-9-11(10)8(5-6-12)7-13-9/h2-4,7,13H,5-6,12H2,1H3
InChIKey
WMBARRJMPVVQEZ-UHFFFAOYSA-N
Compound name
2-(4-methoxy-1H-indol-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

132
Patents

190.11061 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.117886 139.8
[M+Na]+ 213.099828 149.4
[M-H]- 189.103334 142.0
[M+NH4]+ 208.144433 160.4
[M+K]+ 229.073768 145.2
[M+H-H2O]+ 173.107870 133.6
[M+HCOO]- 235.108811 163.7
[M+CH3COO]- 249.124461 183.0
[M+Na-2H]- 211.085276 146.2
[M]+ 190.11006142 140.7
[M]- 190.11115858 140.7
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