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Methyl (3S,5R,6E)-8-Di(4-fluorophenyl)methylidene-3,5-Isopropylidenedioxy-9-methyl-6-decenoate
SpectraBase Compound ID JLq9fsQaiH0
InChI InChI=1S/C28H32F2O4/c1-18(2)25(15-14-23-16-24(17-26(31)32-5)34-28(3,4)33-23)27(19-6-10-21(29)11-7-19)20-8-12-22(30)13-9-20/h6-15,18,23-24H,16-17H2,1-5H3/b15-14+/t23-,24-/m0/s1
InChIKey PVGRQDSRAHIAKP-YNBDVOJHSA-N
Mol Weight 470.6 g/mol
Molecular Formula C28H32F2O4
Exact Mass 470.226866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0FipjJXJdc
Name Methyl (3S,5R,6E)-8-Di(4-fluorophenyl)methylidene-3,5-Isopropylidenedioxy-9-methyl-6-decenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32F2O4
InChI InChI=1S/C28H32F2O4/c1-18(2)25(15-14-23-16-24(17-26(31)32-5)34-28(3,4)33-23)27(19-6-10-21(29)11-7-19)20-8-12-22(30)13-9-20/h6-15,18,23-24H,16-17H2,1-5H3/b15-14+/t23-,24-/m0/s1
InChIKey PVGRQDSRAHIAKP-YNBDVOJHSA-N
Molecular Weight 470.557 g/mol
SMILES C(=C(c1ccc(cc1)F)c1ccc(cc1)F)(\C=C\[C@@]1(OC(C)(C)O[C@@](C1)(CC(=O)OC)[H])[H])C(C)C
SPLASH splash10-0006-0193100000-89717cefd30526693b09
Source of Spectrum AJ-68-368-9
Synonyms Methyl {(4S,6R)-6-[(1E)-4,4-bis(4-fluorophenyl)-3-isopropyl-1,3-butadienyl]-2,2-dimethyl-1,3-dioxan-4-yl}acetate
Wiley ID 772997