CID 245440

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

Structural Information

Molecular Formula
C10H18O7
SMILES
CCOC(=O)OCCOCCOC(=O)OCC
InChI
InChI=1S/C10H18O7/c1-3-14-9(11)16-7-5-13-6-8-17-10(12)15-4-2/h3-8H2,1-2H3
InChIKey
BTGIDKYLTZIVED-UHFFFAOYSA-N
Compound name
2-(2-ethoxycarbonyloxyethoxy)ethyl ethyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

250.10526 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.11254 153.9
[M+Na]+ 273.09448 159.6
[M-H]- 249.09798 153.7
[M+NH4]+ 268.13908 171.1
[M+K]+ 289.06842 161.6
[M+H-H2O]+ 233.10252 147.8
[M+HCOO]- 295.10346 176.6
[M+CH3COO]- 309.11911 190.5
[M+Na-2H]- 271.07993 156.9
[M]+ 250.10471 164.0
[M]- 250.10581 164.0
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