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

927
Patents

200.10486 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.112136 142.5
[M+Na]+ 223.094078 149.5
[M-H]- 199.097584 147.1
[M+NH4]+ 218.138683 162.9
[M+K]+ 239.068018 151.2
[M+H-H2O]+ 183.102120 138.6
[M+HCOO]- 245.103061 162.9
[M+CH3COO]- 259.118711 182.6
[M+Na-2H]- 221.079526 147.6
[M]+ 200.10431142 146.2
[M]- 200.10540858 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