CID 11172250

1-(1h-indol-3-ylmethyl)piperidin-4-amine dihydrochloride

Structural Information

Molecular Formula
C14H19N3
SMILES
C1CN(CCC1N)CC2=CNC3=CC=CC=C32
InChI
InChI=1S/C14H19N3/c15-12-5-7-17(8-6-12)10-11-9-16-14-4-2-1-3-13(11)14/h1-4,9,12,16H,5-8,10,15H2
InChIKey
VKEURNDOWDDXJE-UHFFFAOYSA-N
Compound name
1-(1H-indol-3-ylmethyl)piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

6
Patents

229.1579 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.16518 153.0
[M+Na]+ 252.14712 165.3
[M+NH4]+ 247.19172 161.9
[M+K]+ 268.12106 159.6
[M-H]- 228.15062 156.9
[M+Na-2H]- 250.13257 159.7
[M]+ 229.15735 155.7
[M]- 229.15845 155.7
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