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(4aR,5S,6R,7R,8R,8aR)-4-acetyl-5,7-dibenzoxy-8-(methoxymethoxy)-6-methyl-4a,5,6,7,8,8a-hexahydro-1H-naphthalen-2-one
SpectraBase Compound ID ItCZLZNVj99
InChI InChI=1S/C29H34O6/c1-19-27(33-16-21-10-6-4-7-11-21)26-24(20(2)30)14-23(31)15-25(26)29(35-18-32-3)28(19)34-17-22-12-8-5-9-13-22/h4-14,19,25-29H,15-18H2,1-3H3/t19-,25-,26+,27-,28-,29-/m1/s1
InChIKey ULJNXHJFLAQASC-FHPYXDIBSA-N
Mol Weight 478.6 g/mol
Molecular Formula C29H34O6
Exact Mass 478.235539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1AjG4fXh3uL
Name (4aR,5S,6R,7R,8R,8aR)-4-acetyl-5,7-dibenzoxy-8-(methoxymethoxy)-6-methyl-4a,5,6,7,8,8a-hexahydro-1H-naphthalen-2-one
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Formula C29H34O6
InChI InChI=1S/C29H34O6/c1-19-27(33-16-21-10-6-4-7-11-21)26-24(20(2)30)14-23(31)15-25(26)29(35-18-32-3)28(19)34-17-22-12-8-5-9-13-22/h4-14,19,25-29H,15-18H2,1-3H3/t19-,25-,26+,27-,28-,29-/m1/s1
InChIKey ULJNXHJFLAQASC-FHPYXDIBSA-N
Molecular Weight 478.585 g/mol
SMILES C=1([C@@]2([C@@]([C@@](C)([C@]([C@@]([C@]2([H])CC(C1)=O)(OCOC)[H])(OCc1ccccc1)[H])[H])(OCc1ccccc1)[H])[H])C(=O)C
SPLASH splash10-0006-9030100000-1f7530c4732c282dab57
Source of Spectrum KC-57-3054-20
Synonyms (4aR,5S,6R,7R,8R,8aR)-4-acetyl-5,7-dibenzyloxy-8-(methoxymethoxy)-6-methyl-4a,5,6,7,8,8a-hexahydro-1H-naphthalen-2-one (4aR,5S,6R,7R,8R,8aR)-4-acetyl-8-(methoxymethoxy)-6-methyl-5,7-bis(phenylmethoxy)-4a,5,6,7,8,8a-hexahydro-1H-naphthalen-2-one (4aR,5S,6R,7R,8R,8aR)-4-ethanoyl-8-(methoxymethoxy)-6-methyl-5,7-bis(phenylmethoxy)-4a,5,6,7,8,8a-hexahydro-1H-naphthalen-2-one
Wiley ID 1623698