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1,3-Dioxo-5,6-bis[3',5'-bis(isopropyl)-4'-hydroxyphenyl]biciclo[3.2.0]heptane
SpectraBase Compound ID Le1qJzzcD7o
InChI InChI=1S/C31H40O4/c1-15(2)21-9-19(10-22(16(3)4)29(21)34)25-13-26-27(32)14-28(33)31(25,26)20-11-23(17(5)6)30(35)24(12-20)18(7)8/h9-12,15-18,25-26,34-35H,13-14H2,1-8H3
InChIKey XGTNQPJDFCCRQS-UHFFFAOYSA-N
Mol Weight 476.7 g/mol
Molecular Formula C31H40O4
Exact Mass 476.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BOkikUIv9y1
Name 1,3-Dioxo-5,6-bis[3',5'-bis(isopropyl)-4'-hydroxyphenyl]biciclo[3.2.0]heptane
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Formula C31H40O4
InChI InChI=1S/C31H40O4/c1-15(2)21-9-19(10-22(16(3)4)29(21)34)25-13-26-27(32)14-28(33)31(25,26)20-11-23(17(5)6)30(35)24(12-20)18(7)8/h9-12,15-18,25-26,34-35H,13-14H2,1-8H3
InChIKey XGTNQPJDFCCRQS-UHFFFAOYSA-N
Molecular Weight 476.657 g/mol
SMILES Oc1c(cc(C2CC3C2(c2cc(c(c(c2)C(C)C)O)C(C)C)C(CC3=O)=O)cc1C(C)C)C(C)C
SPLASH splash10-001i-0965400000-49493b8683606c16215b
Source of Spectrum O-33-322-23
Wiley ID 763161