CID 3041653

2-methylene-3-cyclohexyloxazolidine-4,5-dione

Structural Information

Molecular Formula

C₁₀H₁₃NO₃

SMILES

C=C1N(C(=O)C(=O)O1)C2CCCCC2

InChI

InChI=1S/C10H13NO3/c1-7-11(9(12)10(13)14-7)8-5-3-2-4-6-8/h8H,1-6H2

InChIKey

XJAKGMJNJANMQI-UHFFFAOYSA-N

Compound name

3-cyclohexyl-2-methylidene-1,3-oxazolidine-4,5-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 195.08954 Da
Monoisotopic Mass: 2.2
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]+	196.096816	141.2
[M+Na]+	218.078758	147.9
[M-H]-	194.082264	146.7
[M+NH4]+	213.123363	159.5
[M+K]+	234.052698	146.7
[M+H-H2O]+	178.086800	134.9
[M+HCOO]-	240.087741	159.4
[M+CH3COO]-	254.103391	181.5
[M+Na-2H]-	216.064206	142.7
[M]+	195.08899142	136.9
[M]-	195.09008858	136.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.