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(4S,5R,8S,9R)-4,9-diphenyl-5,8-divinyl-dodecane-2,11-dione
SpectraBase Compound ID 95Wm8xVyuW
InChI InChI=1S/C28H34O2/c1-5-23(27(19-21(3)29)25-13-9-7-10-14-25)17-18-24(6-2)28(20-22(4)30)26-15-11-8-12-16-26/h5-16,23-24,27-28H,1-2,17-20H2,3-4H3/t23-,24+,27-,28+
InChIKey JYHBGXIGQNNIRT-GQYOUUAKSA-N
Mol Weight 402.6 g/mol
Molecular Formula C28H34O2
Exact Mass 402.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kpFGyT2pbC
Name (4S,5R,8S,9R)-4,9-diphenyl-5,8-divinyl-dodecane-2,11-dione
Alternate Name(s) (4S,5R,8S,9R)-5,8-bis(ethenyl)-4,9-diphenyl-dodecane-2,11-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H34O2
InChI InChI=1S/C28H34O2/c1-5-23(27(19-21(3)29)25-13-9-7-10-14-25)17-18-24(6-2)28(20-22(4)30)26-15-11-8-12-16-26/h5-16,23-24,27-28H,1-2,17-20H2,3-4H3/t23-,24+,27-,28+
InChIKey JYHBGXIGQNNIRT-GQYOUUAKSA-N
Molecular Weight 402.578 g/mol
SMILES [C@@](CC(=O)C)([C@@](C=C)(CC[C@]([C@@](CC(=O)C)(c1ccccc1)[H])(C=C)[H])[H])(c1ccccc1)[H]
SPLASH splash10-0006-9300000000-986a42f6afcd71c5c276
Source of Spectrum J-63-2152-3
Wiley ID 1370718