CID 138991413

2309469-57-4

Structural Information

Molecular Formula

C₁₀H₁₉NO

SMILES

C1CCOCC2(C1)CCNCC2

InChI

InChI=1S/C10H19NO/c1-2-8-12-9-10(3-1)4-6-11-7-5-10/h11H,1-9H2

InChIKey

QVOVAIOAIYWBFM-UHFFFAOYSA-N

Compound name

8-oxa-3-azaspiro[5.6]dodecane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 169.14667 Da
Monoisotopic Mass: 1.1
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]+	170.15395	136.0
[M+Na]+	192.13589	136.9
[M-H]-	168.13939	138.7
[M+NH4]+	187.18049	153.0
[M+K]+	208.10983	138.9
[M+H-H2O]+	152.14393	129.1
[M+HCOO]-	214.14487	149.0
[M+CH3COO]-	228.16052	145.8
[M+Na-2H]-	190.12134	142.2
[M]+	169.14612	123.6
[M]-	169.14722	123.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.