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(.alpha.R,.beta.S;.alpha.S,.beta.R)-2-(Acetoxty-4-nitrophenylmethyl)-2,4,6-trimethoxybenzo[b]furan-3(2H)-one
SpectraBase Compound ID 2LTH7ISakFu
InChI InChI=1S/C20H19NO9/c1-11(22)29-19(12-5-7-13(8-6-12)21(24)25)20(28-4)18(23)17-15(27-3)9-14(26-2)10-16(17)30-20/h5-10,19H,1-4H3/t19-,20-/m0/s1
InChIKey OCZIHADNMUWEJH-PMACEKPBSA-N
Mol Weight 417.37 g/mol
Molecular Formula C20H19NO9
Exact Mass 417.105981 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62ftZIR3zFW
Name (.alpha.R,.beta.S;.alpha.S,.beta.R)-2-(Acetoxty-4-nitrophenylmethyl)-2,4,6-trimethoxybenzo[b]furan-3(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO9
InChI InChI=1S/C20H19NO9/c1-11(22)29-19(12-5-7-13(8-6-12)21(24)25)20(28-4)18(23)17-15(27-3)9-14(26-2)10-16(17)30-20/h5-10,19H,1-4H3/t19-,20-/m0/s1
InChIKey OCZIHADNMUWEJH-PMACEKPBSA-N
Molecular Weight 417.370 g/mol
SMILES [C@@]1(C(c2c(cc(cc2O1)OC)OC)=O)([C@@](OC(=O)C)(c1ccc(N(=O)=O)cc1)[H])OC
SPLASH splash10-00di-0190000000-2ce748b66b7a557db5d4
Source of Spectrum F-52-7175-30
Synonyms (S)-(4-nitrophenyl)[(2R)-2,4,6-trimethoxy-3-oxo-2,3-dihydro-1-benzofuran-2-yl]methyl acetate
Wiley ID 796660