CID 23600

Diglycidyl isophthalate

Structural Information

Molecular Formula
C14H14O6
SMILES
C1C(O1)COC(=O)C2=CC(=CC=C2)C(=O)OCC3CO3
InChI
InChI=1S/C14H14O6/c15-13(19-7-11-5-17-11)9-2-1-3-10(4-9)14(16)20-8-12-6-18-12/h1-4,11-12H,5-8H2
InChIKey
ZXOATMQSUNJNNG-UHFFFAOYSA-N
Compound name
bis(oxiran-2-ylmethyl) benzene-1,3-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3889
Patents

278.07904 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.08632 166.3
[M+Na]+ 301.06826 173.2
[M-H]- 277.07176 177.0
[M+NH4]+ 296.11286 169.1
[M+K]+ 317.04220 174.4
[M+H-H2O]+ 261.07630 159.0
[M+HCOO]- 323.07724 184.3
[M+CH3COO]- 337.09289 206.2
[M+Na-2H]- 299.05371 169.3
[M]+ 278.07849 175.7
[M]- 278.07959 175.7
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