CID 33560

26628-87-5

Structural Information

Molecular Formula
C15H20N2
SMILES
C1CCN(CC1)CCC2=CNC3=CC=CC=C32
InChI
InChI=1S/C15H20N2/c1-4-9-17(10-5-1)11-8-13-12-16-15-7-3-2-6-14(13)15/h2-3,6-7,12,16H,1,4-5,8-11H2
InChIKey
PJVCNRSWJSLGCV-UHFFFAOYSA-N
Compound name
3-(2-piperidin-1-ylethyl)-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

28
Patents

228.16264 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.16992 153.1
[M+Na]+ 251.15186 159.1
[M-H]- 227.15536 155.7
[M+NH4]+ 246.19646 170.2
[M+K]+ 267.12580 153.5
[M+H-H2O]+ 211.15990 144.4
[M+HCOO]- 273.16084 170.7
[M+CH3COO]- 287.17649 163.8
[M+Na-2H]- 249.13731 157.6
[M]+ 228.16209 148.7
[M]- 228.16319 148.7
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