CID 18934204

69701-99-1

Structural Information

Molecular Formula

C₁₀H₁₆O₄

SMILES

CCC1(OCC(O1)COC(=O)C=C)C

InChI

InChI=1S/C10H16O4/c1-4-9(11)12-6-8-7-13-10(3,5-2)14-8/h4,8H,1,5-7H2,2-3H3

InChIKey

VWAQEEYHYXPMHK-UHFFFAOYSA-N

Compound name

(2-ethyl-2-methyl-1,3-dioxolan-4-yl)methyl prop-2-enoate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 991
Patents: 200.10486 Da
Monoisotopic Mass: 1.5
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]+	201.11214	144.1
[M+Na]+	223.09408	153.1
[M+NH4]+	218.13868	151.9
[M+K]+	239.06802	149.3
[M-H]-	199.09758	146.0
[M+Na-2H]-	221.07953	146.9
[M]+	200.10431	145.7
[M]-	200.10541	145.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe