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2(S)-(1'-Hydroxy-1'-methylethyl)-5-hydroxy-7-[methoxycarbonyl]-2,3-dihydrobenzofuran
SpectraBase Compound ID 8BY3Y0IOMZ7
InChI InChI=1S/C13H16O5/c1-13(2,16)10-5-7-4-8(14)6-9(11(7)18-10)12(15)17-3/h4,6,10,14,16H,5H2,1-3H3/t10-/m0/s1
InChIKey CWCRUPBHPLOKLA-JTQLQIEISA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3j6la9Lr3o1
Name 2(S)-(1'-Hydroxy-1'-methylethyl)-5-hydroxy-7-[methoxycarbonyl]-2,3-dihydrobenzofuran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-13(2,16)10-5-7-4-8(14)6-9(11(7)18-10)12(15)17-3/h4,6,10,14,16H,5H2,1-3H3/t10-/m0/s1
InChIKey CWCRUPBHPLOKLA-JTQLQIEISA-N
Molecular Weight 252.266 g/mol
SMILES OC([C@]1(Oc2c(cc(cc2C(=O)OC)O)C1)[H])(C)C
SPLASH splash10-0lyo-1940000000-3b4161dee396d9ddfa74
Source of Spectrum G4-71-1149-4
Synonyms Methyl 7-hydroxyanodendroate
Wiley ID 1694973