CID 137698753

1880830-14-7

Structural Information

Molecular Formula
C10H14O5
SMILES
CCOC(=O)C(=O)C1COC(C1=O)(C)C
InChI
InChI=1S/C10H14O5/c1-4-14-9(13)7(11)6-5-15-10(2,3)8(6)12/h6H,4-5H2,1-3H3
InChIKey
AGNXAJRHVVXGPQ-UHFFFAOYSA-N
Compound name
ethyl 2-(5,5-dimethyl-4-oxooxolan-3-yl)-2-oxoacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.08412 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.091396 142.1
[M+Na]+ 237.073338 149.9
[M-H]- 213.076844 146.5
[M+NH4]+ 232.117943 163.3
[M+K]+ 253.047278 151.2
[M+H-H2O]+ 197.081380 138.5
[M+HCOO]- 259.082321 162.9
[M+CH3COO]- 273.097971 185.8
[M+Na-2H]- 235.058786 144.8
[M]+ 214.08357142 145.8
[M]- 214.08466858 145.8
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

No patent data available for this compound.