CID 3077983

Brn 5336769

Structural Information

Molecular Formula

C₁₀H₁₅NO₃

SMILES

C1CCC2(CC1)C(CC(=O)O2)C(=O)N

InChI

InChI=1S/C10H15NO3/c11-9(13)7-6-8(12)14-10(7)4-2-1-3-5-10/h7H,1-6H2,(H2,11,13)

InChIKey

UEDBNGWFGWOXCL-UHFFFAOYSA-N

Compound name

2-oxo-1-oxaspiro[4.5]decane-4-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 197.1052 Da
Monoisotopic Mass: 0.3
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]+	198.112476	142.7
[M+Na]+	220.094418	147.7
[M-H]-	196.097924	147.8
[M+NH4]+	215.139023	163.7
[M+K]+	236.068358	147.2
[M+H-H2O]+	180.102460	137.6
[M+HCOO]-	242.103401	161.3
[M+CH3COO]-	256.119051	182.3
[M+Na-2H]-	218.079866	145.7
[M]+	197.10465142	136.6
[M]-	197.10574858	136.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe