CID 144047

4-ethylphenethylamine

Structural Information

Molecular Formula

C₁₀H₁₅N

SMILES

CCC1=CC=C(C=C1)CCN

InChI

InChI=1S/C10H15N/c1-2-9-3-5-10(6-4-9)7-8-11/h3-6H,2,7-8,11H2,1H3

InChIKey

XLJAVPNHXCHBPU-UHFFFAOYSA-N

Compound name

2-(4-ethylphenyl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 314
Patents: 149.12045 Da
Monoisotopic Mass: 2.0
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]+	150.12773	132.6
[M+Na]+	172.10967	145.2
[M+NH4]+	167.15427	142.1
[M+K]+	188.08361	137.7
[M-H]-	148.11317	136.2
[M+Na-2H]-	170.09512	140.2
[M]+	149.11990	135.4
[M]-	149.12100	135.4

Literature stripe

literature stripe

Patent stripe

patents stripe