CID 20761876

1-methyl-1,4-diazaspiro[5.5]undecane dihydrochloride

Structural Information

Molecular Formula

C₁₀H₂₀N₂

SMILES

CN1CCNCC12CCCCC2

InChI

InChI=1S/C10H20N2/c1-12-8-7-11-9-10(12)5-3-2-4-6-10/h11H,2-9H2,1H3

InChIKey

JEULWRNDCDRAIW-UHFFFAOYSA-N

Compound name

1-methyl-1,4-diazaspiro[5.5]undecane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 168.16264 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]+	169.16992	143.0
[M+Na]+	191.15186	153.4
[M+NH4]+	186.19646	153.5
[M+K]+	207.12580	144.6
[M-H]-	167.15536	145.3
[M+Na-2H]-	189.13731	149.4
[M]+	168.16209	145.1
[M]-	168.16319	145.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe