CID 18934204

2-propenoic acid, (2-ethyl-2-methyl-1,3-dioxolan-4-yl)methyl ester

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

1021
Patents

200.10486 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.11214 142.5
[M+Na]+ 223.09408 149.5
[M-H]- 199.09758 147.1
[M+NH4]+ 218.13868 162.9
[M+K]+ 239.06802 151.2
[M+H-H2O]+ 183.10212 138.6
[M+HCOO]- 245.10306 162.9
[M+CH3COO]- 259.11871 182.6
[M+Na-2H]- 221.07953 147.6
[M]+ 200.10431 146.2
[M]- 200.10541 146.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe