CID 440945

3-(2-aminoethyl)-1-methyl-1h-indol-5-ol hydrochloride

Structural Information

Molecular Formula
C11H14N2O
SMILES
CN1C=C(C2=C1C=CC(=C2)O)CCN
InChI
InChI=1S/C11H14N2O/c1-13-7-8(4-5-12)10-6-9(14)2-3-11(10)13/h2-3,6-7,14H,4-5,12H2,1H3
InChIKey
RLDFVSFNVOLFEU-UHFFFAOYSA-N
Compound name
3-(2-aminoethyl)-1-methylindol-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

190.11061 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.117886 140.1
[M+Na]+ 213.099828 150.6
[M-H]- 189.103334 142.6
[M+NH4]+ 208.144433 161.0
[M+K]+ 229.073768 146.4
[M+H-H2O]+ 173.107870 134.2
[M+HCOO]- 235.108811 164.0
[M+CH3COO]- 249.124461 184.2
[M+Na-2H]- 211.085276 145.7
[M]+ 190.11006142 141.3
[M]- 190.11115858 141.3
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