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5,5;10,10-Bis[3,3'-dimethyl-1',5'-dioxapentane-1',5'-diyl]-2,13-dioxo-3,12-dioxatricyclo[12.3.2(6,9).1(1,14)]icosan-1(20),6,8,14,16,18-hexaene

View entire compound with spectra: 1 MS (GC)

5,5;10,10-Bis[3,3'-dimethyl-1',5'-dioxapentane-1',5'-diyl]-2,13-dioxo-3,12-dioxatricyclo[12.3.2(6,9).1(1,14)]icosan-1(20),6,8,14,16,18-hexaene
SpectraBase Compound ID 35s0N2CZ9W
InChI InChI=1S/C28H32O8/c1-25(2)13-33-27(34-14-25)17-31-23(29)19-5-7-20(8-6-19)24(30)32-18-28(22-11-9-21(27)10-12-22)35-15-26(3,4)16-36-28/h5-12H,13-18H2,1-4H3
InChIKey GKXJDHJNBHZQQZ-UHFFFAOYSA-N
Mol Weight 496.6 g/mol
Molecular Formula C28H32O8
Exact Mass 496.209718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HvGJtm30GEo
Name 5,5;10,10-Bis[3,3'-dimethyl-1',5'-dioxapentane-1',5'-diyl]-2,13-dioxo-3,12-dioxatricyclo[12.3.2(6,9).1(1,14)]icosan-1(20),6,8,14,16,18-hexaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32O8
InChI InChI=1S/C28H32O8/c1-25(2)13-33-27(34-14-25)17-31-23(29)19-5-7-20(8-6-19)24(30)32-18-28(22-11-9-21(27)10-12-22)35-15-26(3,4)16-36-28/h5-12H,13-18H2,1-4H3
InChIKey GKXJDHJNBHZQQZ-UHFFFAOYSA-N
Molecular Weight 496.556 g/mol
SMILES C12(OCC(CO2)(C)C)c2ccc(C3(OCC(CO3)(C)C)COC(c3ccc(C(OC1)=O)cc3)=O)cc2
SPLASH splash10-0gba-9830300000-49d7cd8dbe787254f2f1
Source of Spectrum J-73-5837-7a
Wiley ID 1668471