CID 3054773

71765-50-9

Structural Information

Molecular Formula
C15H16N2O3
SMILES
C1CC(CN(C1)C(=O)C(=O)C2=CNC3=CC=CC=C32)O
InChI
InChI=1S/C15H16N2O3/c18-10-4-3-7-17(9-10)15(20)14(19)12-8-16-13-6-2-1-5-11(12)13/h1-2,5-6,8,10,16,18H,3-4,7,9H2
InChIKey
HRQXLXFKMWLFGA-UHFFFAOYSA-N
Compound name
1-(3-hydroxypiperidin-1-yl)-2-(1H-indol-3-yl)ethane-1,2-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.1161 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.12338 161.4
[M+Na]+ 295.10532 167.5
[M-H]- 271.10882 163.5
[M+NH4]+ 290.14992 175.8
[M+K]+ 311.07926 162.8
[M+H-H2O]+ 255.11336 153.4
[M+HCOO]- 317.11430 176.4
[M+CH3COO]- 331.12995 171.3
[M+Na-2H]- 293.09077 162.7
[M]+ 272.11555 157.2
[M]- 272.11665 157.2
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

patents stripe