CID 58311

2-acetyl-9-(3-(4-ethoxypiperidino)propyl)carbazole hydrochloride

Structural Information

Molecular Formula

C₂₄H₃₀N₂O₂

SMILES

CCOC1CCN(CC1)CCCN2C3=CC=CC=C3C4=C2C=C(C=C4)C(=O)C

InChI

InChI=1S/C24H30N2O2/c1-3-28-20-11-15-25(16-12-20)13-6-14-26-23-8-5-4-7-21(23)22-10-9-19(18(2)27)17-24(22)26/h4-5,7-10,17,20H,3,6,11-16H2,1-2H3

InChIKey

QDUOVHFQMMAOIU-UHFFFAOYSA-N

Compound name

1-[9-[3-(4-ethoxypiperidin-1-yl)propyl]carbazol-2-yl]ethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 378.23074 Da
Monoisotopic Mass: 4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	379.238016	195.9
[M+Na]+	401.219958	201.8
[M-H]-	377.223464	200.6
[M+NH4]+	396.264563	208.6
[M+K]+	417.193898	195.4
[M+H-H2O]+	361.228000	185.4
[M+HCOO]-	423.228941	210.8
[M+CH3COO]-	437.244591	204.3
[M+Na-2H]-	399.205406	195.3
[M]+	378.23019142	197.4
[M]-	378.23128858	197.4

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.