CID 225375

18908-20-8

Structural Information

Molecular Formula

C₈H₁₀O₃

SMILES

CC(=C)CC1CC(=O)OC1=O

InChI

InChI=1S/C8H10O3/c1-5(2)3-6-4-7(9)11-8(6)10/h6H,1,3-4H2,2H3

InChIKey

ANPMHDUGFOMMJJ-UHFFFAOYSA-N

Compound name

3-(2-methylprop-2-enyl)oxolane-2,5-dione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 271
Patents: 154.06299 Da
Monoisotopic Mass: 1.3
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]+	155.07027	131.9
[M+Na]+	177.05221	141.7
[M+NH4]+	172.09681	139.1
[M+K]+	193.02615	139.3
[M-H]-	153.05571	132.9
[M+Na-2H]-	175.03766	134.2
[M]+	154.06244	133.2
[M]-	154.06354	133.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe