CID 365605

119464-27-6

Structural Information

Molecular Formula
C24H28N4O
SMILES
C1CCN(CC1)CCC(=O)N2CCC3=C(C2C4=CN=CC=C4)NC5=CC=CC=C35
InChI
InChI=1S/C24H28N4O/c29-22(11-15-27-13-4-1-5-14-27)28-16-10-20-19-8-2-3-9-21(19)26-23(20)24(28)18-7-6-12-25-17-18/h2-3,6-9,12,17,24,26H,1,4-5,10-11,13-16H2
InChIKey
QSBRTZBQSHLYRI-UHFFFAOYSA-N
Compound name
3-piperidin-1-yl-1-(1-pyridin-3-yl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

388.22632 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.23360 197.5
[M+Na]+ 411.21554 211.4
[M+NH4]+ 406.26014 204.9
[M+K]+ 427.18948 204.2
[M-H]- 387.21904 202.1
[M+Na-2H]- 409.20099 203.7
[M]+ 388.22577 200.7
[M]- 388.22687 200.7
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.