CID 59002

1-allyl-3-skatylpiperidine

Structural Information

Molecular Formula
C17H22N2
SMILES
C=CCN1CCCC(C1)CC2=CNC3=CC=CC=C32
InChI
InChI=1S/C17H22N2/c1-2-9-19-10-5-6-14(13-19)11-15-12-18-17-8-4-3-7-16(15)17/h2-4,7-8,12,14,18H,1,5-6,9-11,13H2
InChIKey
BFEQJRWPEVFLHK-UHFFFAOYSA-N
Compound name
3-[(1-prop-2-enylpiperidin-3-yl)methyl]-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.1783 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.18558 162.6
[M+Na]+ 277.16752 175.9
[M+NH4]+ 272.21212 171.3
[M+K]+ 293.14146 168.6
[M-H]- 253.17102 166.1
[M+Na-2H]- 275.15297 169.1
[M]+ 254.17775 165.4
[M]- 254.17885 165.4
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.