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

30
Patents

250.10526 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.112536 153.9
[M+Na]+ 273.094478 159.6
[M-H]- 249.097984 153.7
[M+NH4]+ 268.139083 171.1
[M+K]+ 289.068418 161.6
[M+H-H2O]+ 233.102520 147.8
[M+HCOO]- 295.103461 176.6
[M+CH3COO]- 309.119111 190.5
[M+Na-2H]- 271.079926 156.9
[M]+ 250.10471142 164.0
[M]- 250.10580858 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