CID 134990480

Dtxsid901019645

Structural Information

Molecular Formula

C₂₀H₂₂N₂

SMILES

C[C@@H](C1=CC=CC=C1)N[C@@H]2CCC3=C(C2)C4=CC=CC=C4N3

InChI

InChI=1S/C20H22N2/c1-14(15-7-3-2-4-8-15)21-16-11-12-20-18(13-16)17-9-5-6-10-19(17)22-20/h2-10,14,16,21-22H,11-13H2,1H3/t14-,16+/m0/s1

InChIKey

JMGAUCMGJZINFQ-GOEBONIOSA-N

Compound name

(3R)-N-[(1S)-1-phenylethyl]-2,3,4,9-tetrahydro-1H-carbazol-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 290.17828 Da
Monoisotopic Mass: 4.3
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]+	291.185556	167.3
[M+Na]+	313.167498	173.2
[M-H]-	289.171004	172.6
[M+NH4]+	308.212103	184.0
[M+K]+	329.141438	166.1
[M+H-H2O]+	273.175540	158.8
[M+HCOO]-	335.176481	185.7
[M+CH3COO]-	349.192131	177.5
[M+Na-2H]-	311.152946	171.9
[M]+	290.17773142	163.5
[M]-	290.17882858	163.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.