CID 2107

3-(2-aminopropyl)-1h-indol-5-ol

Structural Information

Molecular Formula
C11H14N2O
SMILES
CC(CC1=CNC2=C1C=C(C=C2)O)N
InChI
InChI=1S/C11H14N2O/c1-7(12)4-8-6-13-11-3-2-9(14)5-10(8)11/h2-3,5-7,13-14H,4,12H2,1H3
InChIKey
LYPCGXKCQDYTFV-UHFFFAOYSA-N
Compound name
3-(2-aminopropyl)-1H-indol-5-ol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

210
References

546
Patents

190.11061 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 140.7
[M+Na]+ 213.09983 152.1
[M+NH4]+ 208.14443 148.7
[M+K]+ 229.07377 148.4
[M-H]- 189.10333 142.0
[M+Na-2H]- 211.08528 145.7
[M]+ 190.11006 142.5
[M]- 190.11116 142.5
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