CID 637989

2-azaadamantane hydrochloride

Structural Information

Molecular Formula

C₉H₁₅N

SMILES

C1C2CC3CC1CC(C2)N3

InChI

InChI=1S/C9H15N/c1-6-2-8-4-7(1)5-9(3-6)10-8/h6-10H,1-5H2

InChIKey

ZLSDEVRDASOICE-UHFFFAOYSA-N

Compound name

2-azatricyclo[3.3.1.13,7]decane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 548
Patents: 137.12045 Da
Monoisotopic Mass: 1.7
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]+	138.12773	127.9
[M+Na]+	160.10967	138.1
[M+NH4]+	155.15427	140.2
[M+K]+	176.08361	130.4
[M-H]-	136.11317	126.1
[M+Na-2H]-	158.09512	125.1
[M]+	137.11990	128.8
[M]-	137.12100	128.8

Literature stripe

literature stripe

Patent stripe

patents stripe