CID 24847103

102504-85-8

Structural Information

Molecular Formula
C20H28N4O2
SMILES
C1CN2CCC1C(C2N3CCC4(CC3)C(=O)NCN4C5=CC=CC=C5)O
InChI
InChI=1S/C20H28N4O2/c25-17-15-6-10-22(11-7-15)18(17)23-12-8-20(9-13-23)19(26)21-14-24(20)16-4-2-1-3-5-16/h1-5,15,17-18,25H,6-14H2,(H,21,26)
InChIKey
JDTQWDZKGLSFIE-UHFFFAOYSA-N
Compound name
8-(3-hydroxy-1-azabicyclo[2.2.2]octan-2-yl)-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.22122 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.22850 185.4
[M+Na]+ 379.21044 194.8
[M+NH4]+ 374.25504 195.1
[M+K]+ 395.18438 187.7
[M-H]- 355.21394 185.3
[M+Na-2H]- 377.19589 183.8
[M]+ 356.22067 186.5
[M]- 356.22177 186.5
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.