CID 1538502

N-ethyladamantan-2-amine hydrochloride

Structural Information

Molecular Formula

C₁₂H₂₁N

SMILES

CCNC1C2CC3CC(C2)CC1C3

InChI

InChI=1S/C12H21N/c1-2-13-12-10-4-8-3-9(6-10)7-11(12)5-8/h8-13H,2-7H2,1H3

InChIKey

LBUOWFRNFOQBRE-UHFFFAOYSA-N

Compound name

N-ethyladamantan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 29
Patents: 179.1674 Da
Monoisotopic Mass: 2.5
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]+	180.17468	138.2
[M+Na]+	202.15662	147.6
[M+NH4]+	197.20122	150.7
[M+K]+	218.13056	139.4
[M-H]-	178.16012	137.9
[M+Na-2H]-	200.14207	135.3
[M]+	179.16685	139.4
[M]-	179.16795	139.4

Literature stripe

literature stripe

Patent stripe

patents stripe