CID 88855

2-(methacryloyloxy)ethyl acetoacetate

Structural Information

Molecular Formula
C10H14O5
SMILES
CC(=C)C(=O)OCCOC(=O)CC(=O)C
InChI
InChI=1S/C10H14O5/c1-7(2)10(13)15-5-4-14-9(12)6-8(3)11/h1,4-6H2,2-3H3
InChIKey
IBDVWXAVKPRHCU-UHFFFAOYSA-N
Compound name
2-(2-methylprop-2-enoyloxy)ethyl 3-oxobutanoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

13
References

18727
Patents

214.08412 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.09140 145.6
[M+Na]+ 237.07334 151.5
[M-H]- 213.07684 145.6
[M+NH4]+ 232.11794 163.9
[M+K]+ 253.04728 152.1
[M+H-H2O]+ 197.08138 140.4
[M+HCOO]- 259.08232 166.2
[M+CH3COO]- 273.09797 187.7
[M+Na-2H]- 235.05879 145.9
[M]+ 214.08357 150.2
[M]- 214.08467 150.2
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