CID 10176401

2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one

Structural Information

Molecular Formula

C₁₀H₁₇NO₂

SMILES

CC1C(=O)CC2(O1)CCN(CC2)C

InChI

InChI=1S/C10H17NO2/c1-8-9(12)7-10(13-8)3-5-11(2)6-4-10/h8H,3-7H2,1-2H3

InChIKey

OODDNJQTVFMGCF-UHFFFAOYSA-N

Compound name

2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 61
Patents: 183.12593 Da
Monoisotopic Mass: 0.4
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]+	184.13321	139.8
[M+Na]+	206.11515	146.8
[M-H]-	182.11865	144.4
[M+NH4]+	201.15975	161.4
[M+K]+	222.08909	146.3
[M+H-H2O]+	166.12319	134.2
[M+HCOO]-	228.12413	157.5
[M+CH3COO]-	242.13978	179.7
[M+Na-2H]-	204.10060	143.7
[M]+	183.12538	136.2
[M]-	183.12648	136.2

Literature stripe

literature stripe

Patent stripe

patents stripe