CID 2286

Bisphenol a diglycidyl ether

Structural Information

Molecular Formula
C21H24O4
SMILES
CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4
InChI
InChI=1S/C21H24O4/c1-21(2,15-3-7-17(8-4-15)22-11-19-13-24-19)16-5-9-18(10-6-16)23-12-20-14-25-20/h3-10,19-20H,11-14H2,1-2H3
InChIKey
LCFVJGUPQDGYKZ-UHFFFAOYSA-N
Compound name
2-[[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]methyl]oxirane
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

315
References

82010
Patents

340.16745 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.17473 179.0
[M+Na]+ 363.15667 185.3
[M-H]- 339.16017 191.7
[M+NH4]+ 358.20127 179.9
[M+K]+ 379.13061 186.4
[M+H-H2O]+ 323.16471 171.1
[M+HCOO]- 385.16565 196.4
[M+CH3COO]- 399.18130 218.7
[M+Na-2H]- 361.14212 183.1
[M]+ 340.16690 187.7
[M]- 340.16800 187.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe