CID 365671

2,3,4,9-tetrahydro-9-methyl-2-(2-(4-phenyl-1-piperazinyl)ethyl)-1h-pyrido(3,4-b)indol-1-one

Structural Information

Molecular Formula
C24H28N4O
SMILES
CN1C2=CC=CC=C2C3=C1C(=O)N(CC3)CCN4CCN(CC4)C5=CC=CC=C5
InChI
InChI=1S/C24H28N4O/c1-25-22-10-6-5-9-20(22)21-11-12-28(24(29)23(21)25)18-15-26-13-16-27(17-14-26)19-7-3-2-4-8-19/h2-10H,11-18H2,1H3
InChIKey
BTPVVTGVKFFPPJ-UHFFFAOYSA-N
Compound name
9-methyl-2-[2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydropyrido[3,4-b]indol-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

388.22632 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.23360 199.4
[M+Na]+ 411.21554 205.7
[M-H]- 387.21904 204.3
[M+NH4]+ 406.26014 208.3
[M+K]+ 427.18948 197.3
[M+H-H2O]+ 371.22358 186.0
[M+HCOO]- 433.22452 210.5
[M+CH3COO]- 447.24017 206.3
[M+Na-2H]- 409.20099 198.6
[M]+ 388.22577 195.8
[M]- 388.22687 195.8
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.