CID 58967

1-methyl-2-skatylpiperidine

Structural Information

Molecular Formula
C15H20N2
SMILES
CN1CCCCC1CC2=CNC3=CC=CC=C32
InChI
InChI=1S/C15H20N2/c1-17-9-5-4-6-13(17)10-12-11-16-15-8-3-2-7-14(12)15/h2-3,7-8,11,13,16H,4-6,9-10H2,1H3
InChIKey
QYIFRSRFJBYVDE-UHFFFAOYSA-N
Compound name
3-[(1-methylpiperidin-2-yl)methyl]-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
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 153.5
[M+Na]+ 251.15186 160.5
[M-H]- 227.15536 156.6
[M+NH4]+ 246.19646 171.0
[M+K]+ 267.12580 154.9
[M+H-H2O]+ 211.15990 145.1
[M+HCOO]- 273.16084 171.2
[M+CH3COO]- 287.17649 164.7
[M+Na-2H]- 249.13731 157.3
[M]+ 228.16209 149.6
[M]- 228.16319 149.6
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

patents stripe