CID 116526018

5-azaspiro[2.6]nonane hydrochloride

Structural Information

Molecular Formula

C₈H₁₅N

SMILES

C1CCNCC2(C1)CC2

InChI

InChI=1S/C8H15N/c1-2-6-9-7-8(3-1)4-5-8/h9H,1-7H2

InChIKey

OBDLCKJCSDQQCU-UHFFFAOYSA-N

Compound name

5-azaspiro[2.6]nonane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 125.12045 Da
Monoisotopic Mass: 1.2
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]+	126.127726	123.5
[M+Na]+	148.109668	128.1
[M-H]-	124.113174	127.5
[M+NH4]+	143.154273	139.2
[M+K]+	164.083608	129.8
[M+H-H2O]+	108.117710	117.5
[M+HCOO]-	170.118651	140.7
[M+CH3COO]-	184.134301	134.9
[M+Na-2H]-	146.095116	130.9
[M]+	125.11990142	116.4
[M]-	125.12099858	116.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe