CID 131633375

Glycidyl sorbate dimer

Structural Information

Molecular Formula
C18H24O6
SMILES
C/C=C/C1C(C=CC(C1C(=O)OCC2CO2)C(=O)OCC3CO3)C
InChI
InChI=1S/C18H24O6/c1-3-4-14-11(2)5-6-15(17(19)23-9-12-7-21-12)16(14)18(20)24-10-13-8-22-13/h3-6,11-16H,7-10H2,1-2H3/b4-3+
InChIKey
XHTDCGVGUHWAJM-ONEGZZNKSA-N
Compound name
bis(oxiran-2-ylmethyl) 5-methyl-6-[(E)-prop-1-enyl]cyclohex-3-ene-1,2-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

336.1573 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.16458 154.5
[M+Na]+ 359.14652 165.7
[M+NH4]+ 354.19112 160.6
[M+K]+ 375.12046 165.9
[M-H]- 335.15002 170.4
[M+Na-2H]- 357.13197 162.7
[M]+ 336.15675 162.4
[M]- 336.15785 162.4
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