CID 4722579

880813-36-5

Structural Information

Molecular Formula

C₁₆H₁₈N₂

SMILES

CCN1C2=C(C=C(C=C2)CNC)C3=CC=CC=C31

InChI

InChI=1S/C16H18N2/c1-3-18-15-7-5-4-6-13(15)14-10-12(11-17-2)8-9-16(14)18/h4-10,17H,3,11H2,1-2H3

InChIKey

LBPNOEAFWYTTEB-UHFFFAOYSA-N

Compound name

1-(9-ethylcarbazol-3-yl)-N-methylmethanamine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 8
References: 33
Patents: 238.147 Da
Monoisotopic Mass: 3.0
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]+	239.15428	154.1
[M+Na]+	261.13622	164.3
[M-H]-	237.13972	158.9
[M+NH4]+	256.18082	174.9
[M+K]+	277.11016	158.8
[M+H-H2O]+	221.14426	147.0
[M+HCOO]-	283.14520	178.0
[M+CH3COO]-	297.16085	167.4
[M+Na-2H]-	259.12167	161.4
[M]+	238.14645	157.3
[M]-	238.14755	157.3

Literature stripe

literature stripe

Patent stripe

patents stripe