CID 155821025

Tert-butyl2,6-dioxooxane-4-carboxylate

Structural Information

Molecular Formula
C10H14O5
SMILES
CC(C)(C)OC(=O)C1CC(=O)OC(=O)C1
InChI
InChI=1S/C10H14O5/c1-10(2,3)15-9(13)6-4-7(11)14-8(12)5-6/h6H,4-5H2,1-3H3
InChIKey
JGLQOSLKSMDPOF-UHFFFAOYSA-N
Compound name
tert-butyl 2,6-dioxooxane-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.08412 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.09140 144.4
[M+Na]+ 237.07334 153.7
[M+NH4]+ 232.11794 150.2
[M+K]+ 253.04728 151.2
[M-H]- 213.07684 144.4
[M+Na-2H]- 235.05879 146.4
[M]+ 214.08357 145.4
[M]- 214.08467 145.4
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.