CID 50998995

{spiro[2.5]octan-6-yl}methanamine hydrochloride

Structural Information

Molecular Formula

C₉H₁₇N

SMILES

C1CC2(CCC1CN)CC2

InChI

InChI=1S/C9H17N/c10-7-8-1-3-9(4-2-8)5-6-9/h8H,1-7,10H2

InChIKey

JEDATJQHUZRDBE-UHFFFAOYSA-N

Compound name

spiro[2.5]octan-6-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 14
Patents: 139.1361 Da
Monoisotopic Mass: 2.1
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]+	140.14338	132.2
[M+Na]+	162.12532	143.8
[M+NH4]+	157.16992	144.0
[M+K]+	178.09926	137.0
[M-H]-	138.12882	142.9
[M+Na-2H]-	160.11077	142.0
[M]+	139.13555	138.1
[M]-	139.13665	138.1

Literature stripe

literature stripe

Patent stripe

patents stripe