CID 22417173

6-azaspiro[2.5]octane

Structural Information

Molecular Formula

C₇H₁₃N

SMILES

C1CC12CCNCC2

InChI

InChI=1S/C7H13N/c1-2-7(1)3-5-8-6-4-7/h8H,1-6H2

InChIKey

GIBPTWPJEVCTGR-UHFFFAOYSA-N

Compound name

6-azaspiro[2.5]octane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1324
Patents: 111.1048 Da
Monoisotopic Mass: 1.3
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]+	112.11208	127.7
[M+Na]+	134.09402	140.1
[M+NH4]+	129.13862	139.3
[M+K]+	150.06796	133.2
[M-H]-	110.09752	137.1
[M+Na-2H]-	132.07947	137.7
[M]+	111.10425	133.3
[M]-	111.10535	133.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe