CID 13172824

[({2-[(methoxycarbonyl)oxy]ethoxy}carbonyl)oxy]ethane

Structural Information

Molecular Formula
C7H12O6
SMILES
CCOC(=O)OCCOC(=O)OC
InChI
InChI=1S/C7H12O6/c1-3-11-7(9)13-5-4-12-6(8)10-2/h3-5H2,1-2H3
InChIKey
SSZGVGWDBPYFPT-UHFFFAOYSA-N
Compound name
2-ethoxycarbonyloxyethyl methyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

71
Patents

192.06339 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.070666 137.8
[M+Na]+ 215.052608 144.9
[M-H]- 191.056114 138.2
[M+NH4]+ 210.097213 157.5
[M+K]+ 231.026548 147.1
[M+H-H2O]+ 175.060650 132.6
[M+HCOO]- 237.061591 161.3
[M+CH3COO]- 251.077241 179.5
[M+Na-2H]- 213.038056 142.2
[M]+ 192.06284142 145.3
[M]- 192.06393858 145.3
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