CID 10012381

(2-phenylethyl)(prop-2-en-1-yl)amine

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

C=CCNCCC1=CC=CC=C1

InChI

InChI=1S/C11H15N/c1-2-9-12-10-8-11-6-4-3-5-7-11/h2-7,12H,1,8-10H2

InChIKey

JFKVJZFRJPBLIP-UHFFFAOYSA-N

Compound name

N-(2-phenylethyl)prop-2-en-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 195
Patents: 161.12045 Da
Monoisotopic Mass: 2.4
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]+	162.12773	136.8
[M+Na]+	184.10967	149.2
[M+NH4]+	179.15427	146.0
[M+K]+	200.08361	140.9
[M-H]-	160.11317	140.3
[M+Na-2H]-	182.09512	144.8
[M]+	161.11990	139.5
[M]-	161.12100	139.5

Literature stripe

literature stripe

Patent stripe

patents stripe