CID 309264

Diethyl 2-(2-(vinyloxy)ethyl)malonate

Structural Information

Molecular Formula
C11H18O5
SMILES
CCOC(=O)C(CCOC=C)C(=O)OCC
InChI
InChI=1S/C11H18O5/c1-4-14-8-7-9(10(12)15-5-2)11(13)16-6-3/h4,9H,1,5-8H2,2-3H3
InChIKey
FHBPLNAJCDTIPP-UHFFFAOYSA-N
Compound name
diethyl 2-(2-ethenoxyethyl)propanedioate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

230.11542 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.12270 152.3
[M+Na]+ 253.10464 157.7
[M-H]- 229.10814 152.0
[M+NH4]+ 248.14924 170.2
[M+K]+ 269.07858 158.2
[M+H-H2O]+ 213.11268 146.7
[M+HCOO]- 275.11362 173.4
[M+CH3COO]- 289.12927 190.7
[M+Na-2H]- 251.09009 153.3
[M]+ 230.11487 158.7
[M]- 230.11597 158.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe