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1-.beta.-D-glucuronic acid-4-allyloxy-3-chlorophenylacetate
SpectraBase Compound ID KxiVngyp0o0
InChI InChI=1S/C17H19ClO9/c1-2-5-25-10-4-3-8(6-9(10)18)7-11(19)26-17(24)15-13(21)12(20)14(22)16(23)27-15/h2-4,6,12-16,20-23H,1,5,7H2/t12-,13-,14+,15-,16+/m1/s1
InChIKey UYMGITXESVURTQ-LJIZCISZSA-N
Mol Weight 402.78 g/mol
Molecular Formula C17H19ClO9
Exact Mass 402.07176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E68FLeC6d3S
Name 1-.beta.-D-glucuronic acid-4-allyloxy-3-chlorophenylacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19ClO9
InChI InChI=1S/C17H19ClO9/c1-2-5-25-10-4-3-8(6-9(10)18)7-11(19)26-17(24)15-13(21)12(20)14(22)16(23)27-15/h2-4,6,12-16,20-23H,1,5,7H2/t12-,13-,14+,15-,16+/m1/s1
InChIKey UYMGITXESVURTQ-LJIZCISZSA-N
Molecular Weight 402.783 g/mol
SMILES O[C@@]1([C@]([C@@]([C@]([C@@](O1)(C(OC(=O)Cc1cc(Cl)c(cc1)OCC=C)=O)[H])(O)[H])(O)[H])(O)[H])[H]
SPLASH splash10-0006-8910000000-3ec8be8453d2a28ef284
Source of Spectrum DO-0-35-2
Synonyms [4-(allyloxy)-3-chlorophenyl]acetyl .beta.-L-glucopyranuronate
Wiley ID 1370187