CID 263180

Ethyleneglycol bis-(2,3-epoxybutyrate)

Structural Information

Molecular Formula
C10H14O6
SMILES
CC1C(O1)C(=O)OCCOC(=O)C2C(O2)C
InChI
InChI=1S/C10H14O6/c1-5-7(15-5)9(11)13-3-4-14-10(12)8-6(2)16-8/h5-8H,3-4H2,1-2H3
InChIKey
RASFDPYEJAASRQ-UHFFFAOYSA-N
Compound name
2-(3-methyloxirane-2-carbonyl)oxyethyl 3-methyloxirane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

230.07904 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.08632 158.8
[M+Na]+ 253.06826 166.9
[M-H]- 229.07176 167.6
[M+NH4]+ 248.11286 163.9
[M+K]+ 269.04220 167.8
[M+H-H2O]+ 213.07630 152.3
[M+HCOO]- 275.07724 176.0
[M+CH3COO]- 289.09289 200.9
[M+Na-2H]- 251.05371 160.9
[M]+ 230.07849 169.7
[M]- 230.07959 169.7
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