CID 118210134

2344685-57-8

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

C1COCCNC12COC2

InChI

InChI=1S/C7H13NO2/c1-3-9-4-2-8-7(1)5-10-6-7/h8H,1-6H2

InChIKey

RDYWVPLHFAONCW-UHFFFAOYSA-N

Compound name

2,8-dioxa-5-azaspiro[3.6]decane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 143.09464 Da
Monoisotopic Mass: -0.7
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]+	144.10192	120.6
[M+Na]+	166.08386	122.9
[M-H]-	142.08736	124.9
[M+NH4]+	161.12846	131.8
[M+K]+	182.05780	129.0
[M+H-H2O]+	126.09190	111.4
[M+HCOO]-	188.09284	135.2
[M+CH3COO]-	202.10849	173.9
[M+Na-2H]-	164.06931	129.7
[M]+	143.09409	121.3
[M]-	143.09519	121.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe