CID 154699752

Ns00117490

Structural Information

Molecular Formula
C24H28FN3O2
SMILES
CNC(=O)CC1=CC2=C(C=C1)C=CN2C3CCN(CC3)CC(C4=CC=CC=C4F)O
InChI
InChI=1S/C24H28FN3O2/c1-26-24(30)15-17-6-7-18-8-13-28(22(18)14-17)19-9-11-27(12-10-19)16-23(29)20-4-2-3-5-21(20)25/h2-8,13-14,19,23,29H,9-12,15-16H2,1H3,(H,26,30)
InChIKey
KUSDQXXHLZTPLH-UHFFFAOYSA-N
Compound name
2-[1-[1-[2-(2-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]indol-6-yl]-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

409.21655 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 410.22383 201.1
[M+Na]+ 432.20577 212.4
[M+NH4]+ 427.25037 207.0
[M+K]+ 448.17971 206.9
[M-H]- 408.20927 204.6
[M+Na-2H]- 430.19122 206.7
[M]+ 409.21600 203.4
[M]- 409.21710 203.4
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

No patent data available for this compound.