CID 542480

87292-23-7

Structural Information

Molecular Formula
C8H14O7
SMILES
COC(=O)OCCOCCOC(=O)OC
InChI
InChI=1S/C8H14O7/c1-11-7(9)14-5-3-13-4-6-15-8(10)12-2/h3-6H2,1-2H3
InChIKey
RCPSBJKGQVGFHE-UHFFFAOYSA-N
Compound name
2-(2-methoxycarbonyloxyethoxy)ethyl methyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

222.07396 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.08124 144.6
[M+Na]+ 245.06318 151.0
[M-H]- 221.06668 144.7
[M+NH4]+ 240.10778 162.9
[M+K]+ 261.03712 153.6
[M+H-H2O]+ 205.07122 138.9
[M+HCOO]- 267.07216 167.9
[M+CH3COO]- 281.08781 184.6
[M+Na-2H]- 243.04863 148.5
[M]+ 222.07341 153.9
[M]- 222.07451 153.9
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