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1,4:5,8-dimethano-9H-fluoren-9-one, 10,11-bis(benzoyloxy)-1,4,4a,4b,5,8,8a,9a-ocyahydro-,(1.alpha.,4.alpha.,4a.alpha.,4b.alpha.,5.beta.,8.beta.,8a.beta.,9a.alpha.,10R*,11R*)-
SpectraBase Compound ID ISnDppFzvDY
InChI InChI=1S/C29H24O5/c30-25-23-19-13-11-17(26(19)33-28(31)15-7-3-1-4-8-15)21(23)22-18-12-14-20(24(22)25)27(18)34-29(32)16-9-5-2-6-10-16/h1-14,17-24,26-27H/t17-,18+,19+,20-,21+,22-,23-,24-,26+,27-/m1/s1
InChIKey RJIOUFHTAVKZEF-SHKRQDDXSA-N
Mol Weight 452.51 g/mol
Molecular Formula C29H24O5
Exact Mass 452.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dQN8NYPJtO
Name 1,4:5,8-dimethano-9H-fluoren-9-one, 10,11-bis(benzoyloxy)-1,4,4a,4b,5,8,8a,9a-ocyahydro-,(1.alpha.,4.alpha.,4a.alpha.,4b.alpha.,5.beta.,8.beta.,8a.beta.,9a.alpha.,10R*,11R*)-
Alternate Name(s) (1R,2R,3S,4R,7S,8S,10S,11S,14S,15R)-15-(benzoyloxy)-9-oxopentacyclo[9.2.1.1(4,7).0(2,10).0(3,8)]pentadeca-5,12-dien-14-yl benzoate
CAS Registry Number 104419-67-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H24O5
InChI InChI=1S/C29H24O5/c30-25-23-19-13-11-17(26(19)33-28(31)15-7-3-1-4-8-15)21(23)22-18-12-14-20(24(22)25)27(18)34-29(32)16-9-5-2-6-10-16/h1-14,17-24,26-27H/t17-,18+,19+,20-,21+,22-,23-,24-,26+,27-/m1/s1
InChIKey RJIOUFHTAVKZEF-SHKRQDDXSA-N
Molecular Weight 452.506 g/mol
SMILES [C@]12(C([C@@]3([C@]4(C=C[C@@]([C@@]3([C@@]2([C@]2([H])[C@@]([C@]1(C=C2)[H])(OC(=O)c1ccccc1)[H])[H])[H])([C@]4(OC(=O)c1ccccc1)[H])[H])[H])[H])=O)[H]
SPLASH splash10-0a4i-1900000000-3726b1af24397c3511ba
Source of Spectrum J-51-4099-3
Wiley ID 1388374