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(4S,6S)-4-[(E)-3-[(2R,6R)-6-isopropoxy-3,6-dihydro-2H-pyran-2-yl]allyl]-2,2-dimethyl-6-phenethyl-1,3-dioxane

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(4S,6S)-4-[(E)-3-[(2R,6R)-6-isopropoxy-3,6-dihydro-2H-pyran-2-yl]allyl]-2,2-dimethyl-6-phenethyl-1,3-dioxane
SpectraBase Compound ID 6KU94K8xNaX
InChI InChI=1S/C25H36O4/c1-19(2)26-24-15-9-13-21(27-24)12-8-14-22-18-23(29-25(3,4)28-22)17-16-20-10-6-5-7-11-20/h5-12,15,19,21-24H,13-14,16-18H2,1-4H3/b12-8+/t21-,22-,23-,24+/m0/s1
InChIKey CLACQZAEFUZKKE-NADDIDLLSA-N
Mol Weight 400.6 g/mol
Molecular Formula C25H36O4
Exact Mass 400.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YwjM3GAg5s
Name (4S,6S)-4-[(E)-3-[(2R,6R)-6-isopropoxy-3,6-dihydro-2H-pyran-2-yl]allyl]-2,2-dimethyl-6-phenethyl-1,3-dioxane
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Formula C25H36O4
InChI InChI=1S/C25H36O4/c1-19(2)26-24-15-9-13-21(27-24)12-8-14-22-18-23(29-25(3,4)28-22)17-16-20-10-6-5-7-11-20/h5-12,15,19,21-24H,13-14,16-18H2,1-4H3/b12-8+/t21-,22-,23-,24+/m0/s1
InChIKey CLACQZAEFUZKKE-NADDIDLLSA-N
Molecular Weight 400.559 g/mol
SMILES C1(O[C@@](CCc2ccccc2)(C[C@@](O1)(C\C=C\[C@@]1(O[C@@](OC(C)C)(C=CC1)[H])[H])[H])[H])(C)C
SPLASH splash10-0300-6950000000-aa91995c3f0dc9227a34
Source of Spectrum CV-2004-1493-4
Synonyms (4S,6S)-4-(E)-3-[(2R,6R)-6-Isopropoxy-3,6-dihydro-2H-pyran-2-yl]allyl}-2,2-dimethyl-6-phenylethyl-[1,3]dioxane (4S,6S)-4-[(E)-3-[(2R,6R)-6-isopropoxy-3,6-dihydro-2H-pyran-2-yl]allyl]-2,2-dimethyl-6-(2-phenylethyl)-1,3-dioxane (4S,6S)-2,2-dimethyl-4-(2-phenylethyl)-6-[(E)-3-[(2R,6R)-6-propan-2-yloxy-3,6-dihydro-2H-pyran-2-yl]prop-2-enyl]-1,3-dioxane
Wiley ID 1611569