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(2R,4aR,6S,7R,11aS)-(Z)-2-(p-Methoxyphenyl)-9-acetoxymethyl-m-dioxano[5,4-b]oxon-9-en-7-ol
SpectraBase Compound ID 4vpeMmml0Os
InChI InChI=1S/C20H26O7/c1-13(21)24-11-18-16(22)5-3-4-6-17-19(26-18)12-25-20(27-17)14-7-9-15(23-2)10-8-14/h3-4,7-10,16-20,22H,5-6,11-12H2,1-2H3/b4-3-/t16-,17+,18+,19-,20-/m1/s1
InChIKey BFVBWPTZIAHDNY-OILBGGPFSA-N
Mol Weight 378.42 g/mol
Molecular Formula C20H26O7
Exact Mass 378.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1E2mVJVDaTS
Name (2R,4aR,6S,7R,11aS)-(Z)-2-(p-Methoxyphenyl)-9-acetoxymethyl-m-dioxano[5,4-b]oxon-9-en-7-ol
Alternate Name(s) 1-O-acetyl-2,9-anhydro-4,5,6,7-tetradeoxy-8,10-O-(4-methoxybenzylidene)-D-allo-dec-5-enitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O7
InChI InChI=1S/C20H26O7/c1-13(21)24-11-18-16(22)5-3-4-6-17-19(26-18)12-25-20(27-17)14-7-9-15(23-2)10-8-14/h3-4,7-10,16-20,22H,5-6,11-12H2,1-2H3/b4-3-/t16-,17+,18+,19-,20-/m1/s1
InChIKey BFVBWPTZIAHDNY-OILBGGPFSA-N
Molecular Weight 378.421 g/mol
SMILES O[C@]1([C@@](O[C@]2([C@@](O[C@@](OC2)(c2ccc(cc2)OC)[H])(C\C=C/C1)[H])[H])(COC(=O)C)[H])[H]
SPLASH splash10-004r-0819000000-ae278639a43e3063032c
Source of Spectrum F-55-7496-71
Wiley ID 838400