CID 213648

Ketone, (4-aminopiperidino)methyl indol-3-yl

Structural Information

Molecular Formula
C15H19N3O
SMILES
C1CN(CCC1N)CC(=O)C2=CNC3=CC=CC=C32
InChI
InChI=1S/C15H19N3O/c16-11-5-7-18(8-6-11)10-15(19)13-9-17-14-4-2-1-3-12(13)14/h1-4,9,11,17H,5-8,10,16H2
InChIKey
AFSRRJNFNLLTPC-UHFFFAOYSA-N
Compound name
2-(4-aminopiperidin-1-yl)-1-(1H-indol-3-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.1528 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.16008 159.2
[M+Na]+ 280.14202 165.2
[M-H]- 256.14552 162.0
[M+NH4]+ 275.18662 174.7
[M+K]+ 296.11596 159.7
[M+H-H2O]+ 240.15006 150.7
[M+HCOO]- 302.15100 176.7
[M+CH3COO]- 316.16665 169.4
[M+Na-2H]- 278.12747 161.6
[M]+ 257.15225 153.8
[M]- 257.15335 153.8
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

No patent data available for this compound.