CID 3054783

2-methyl-3-(2-(3-methyl-1-piperidinyl)ethyl)-1h-indole

Structural Information

Molecular Formula
C17H24N2
SMILES
CC1CCCN(C1)CCC2=C(NC3=CC=CC=C32)C
InChI
InChI=1S/C17H24N2/c1-13-6-5-10-19(12-13)11-9-15-14(2)18-17-8-4-3-7-16(15)17/h3-4,7-8,13,18H,5-6,9-12H2,1-2H3
InChIKey
JYWYZIAHFBLSNJ-UHFFFAOYSA-N
Compound name
2-methyl-3-[2-(3-methylpiperidin-1-yl)ethyl]-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.19394 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.20122 163.0
[M+Na]+ 279.18316 170.0
[M-H]- 255.18666 166.1
[M+NH4]+ 274.22776 179.7
[M+K]+ 295.15710 163.9
[M+H-H2O]+ 239.19120 154.4
[M+HCOO]- 301.19214 179.9
[M+CH3COO]- 315.20779 173.6
[M+Na-2H]- 277.16861 164.9
[M]+ 256.19339 160.1
[M]- 256.19449 160.1
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.