CID 21802

Indole, 3-(1-methyl-3-piperidylmethyl)-

Structural Information

Molecular Formula
C15H20N2
SMILES
CN1CCCC(C1)CC2=CNC3=CC=CC=C32
InChI
InChI=1S/C15H20N2/c1-17-8-4-5-12(11-17)9-13-10-16-15-7-3-2-6-14(13)15/h2-3,6-7,10,12,16H,4-5,8-9,11H2,1H3
InChIKey
BZBXURJPKKRGRB-UHFFFAOYSA-N
Compound name
3-[(1-methylpiperidin-3-yl)methyl]-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.16264 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.16992 154.1
[M+Na]+ 251.15186 167.8
[M+NH4]+ 246.19646 163.5
[M+K]+ 267.12580 161.1
[M-H]- 227.15536 158.0
[M+Na-2H]- 249.13731 161.3
[M]+ 228.16209 157.2
[M]- 228.16319 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

No patent data available for this compound.