CID 78175

4437-80-3

Structural Information

Molecular Formula

C₆H₈O₃

SMILES

CC1(C(=C)OC(=O)O1)C

InChI

InChI=1S/C6H8O3/c1-4-6(2,3)9-5(7)8-4/h1H2,2-3H3

InChIKey

WUGCPRNXGBZRMC-UHFFFAOYSA-N

Compound name

4,4-dimethyl-5-methylidene-1,3-dioxolan-2-one

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 909
Patents: 128.04735 Da
Monoisotopic Mass: 1.2
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]+	129.05463	122.3
[M+Na]+	151.03657	133.3
[M+NH4]+	146.08117	131.5
[M+K]+	167.01051	129.4
[M-H]-	127.04007	125.2
[M+Na-2H]-	149.02202	126.8
[M]+	128.04680	124.6
[M]-	128.04790	124.6

Literature stripe

literature stripe

Patent stripe

patents stripe