CID 82074717

2-(1-phenylcyclopropyl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

C1CC1(CCN)C2=CC=CC=C2

InChI

InChI=1S/C11H15N/c12-9-8-11(6-7-11)10-4-2-1-3-5-10/h1-5H,6-9,12H2

InChIKey

JOJBLWZUHONAFV-UHFFFAOYSA-N

Compound name

2-(1-phenylcyclopropyl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 161.12045 Da
Monoisotopic Mass: 2.3
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]+	162.12773	137.4
[M+Na]+	184.10967	151.3
[M+NH4]+	179.15427	149.0
[M+K]+	200.08361	143.4
[M-H]-	160.11317	149.1
[M+Na-2H]-	182.09512	149.9
[M]+	161.11990	144.0
[M]-	161.12100	144.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe