CID 10684

2-amino-3-(1h-indol-3-yl)propan-1-ol

Structural Information

Molecular Formula
C11H14N2O
SMILES
C1=CC=C2C(=C1)C(=CN2)CC(CO)N
InChI
InChI=1S/C11H14N2O/c12-9(7-14)5-8-6-13-11-4-2-1-3-10(8)11/h1-4,6,9,13-14H,5,7,12H2
InChIKey
UDQCRUSSQAXPJY-UHFFFAOYSA-N
Compound name
2-amino-3-(1H-indol-3-yl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

23
References

1166
Patents

190.11061 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 140.8
[M+Na]+ 213.09983 151.8
[M+NH4]+ 208.14443 148.8
[M+K]+ 229.07377 147.9
[M-H]- 189.10333 142.0
[M+Na-2H]- 211.08528 146.0
[M]+ 190.11006 142.4
[M]- 190.11116 142.4
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