CID 61701171

2253639-53-9

Structural Information

Molecular Formula

C₁₂H₁₇N

SMILES

C1CC2=CC=CC=C2CC1CCN

InChI

InChI=1S/C12H17N/c13-8-7-10-5-6-11-3-1-2-4-12(11)9-10/h1-4,10H,5-9,13H2

InChIKey

LXOFPYYEFRMREV-UHFFFAOYSA-N

Compound name

2-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 175.1361 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]+	176.14338	139.0
[M+Na]+	198.12532	151.4
[M+NH4]+	193.16992	149.4
[M+K]+	214.09926	143.2
[M-H]-	174.12882	143.3
[M+Na-2H]-	196.11077	145.8
[M]+	175.13555	142.0
[M]-	175.13665	142.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe