CID 57955599

Methyl 2-ethyloxirane-2-carboxylate

Structural Information

Molecular Formula

C₆H₁₀O₃

SMILES

CCC1(CO1)C(=O)OC

InChI

InChI=1S/C6H10O3/c1-3-6(4-9-6)5(7)8-2/h3-4H2,1-2H3

InChIKey

YODDPJLCFWOVSW-UHFFFAOYSA-N

Compound name

methyl 2-ethyloxirane-2-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 29
Patents: 130.06299 Da
Monoisotopic Mass: 0.5
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]+	131.07027	126.6
[M+Na]+	153.05221	136.6
[M-H]-	129.05571	132.6
[M+NH4]+	148.09681	144.6
[M+K]+	169.02615	138.2
[M+H-H2O]+	113.06025	122.1
[M+HCOO]-	175.06119	149.2
[M+CH3COO]-	189.07684	174.1
[M+Na-2H]-	151.03766	135.1
[M]+	130.06244	133.0
[M]-	130.06354	133.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.