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3,4,6-Tri-O acetyl-2-O-trichloroacetyl-.beta.,D-pyranosyl chloride
SpectraBase Compound ID 9GOsJuRe96P
InChI InChI=1S/C14H16Cl4O9/c1-5(19)23-4-8-9(24-6(2)20)10(25-7(3)21)11(12(15)26-8)27-13(22)14(16,17)18/h8-12H,4H2,1-3H3/t8-,9+,10+,11-,12-/m1/s1
InChIKey QLOCGZWRSGBAGP-YBXAARCKSA-N
Mol Weight 470.1 g/mol
Molecular Formula C14H16Cl4O9
Exact Mass 467.954843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1aQLLqteQxE
Name 3,4,6-Tri-O acetyl-2-O-trichloroacetyl-.beta.,D-pyranosyl chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16Cl4O9
InChI InChI=1S/C14H16Cl4O9/c1-5(19)23-4-8-9(24-6(2)20)10(25-7(3)21)11(12(15)26-8)27-13(22)14(16,17)18/h8-12H,4H2,1-3H3/t8-,9+,10+,11-,12-/m1/s1
InChIKey QLOCGZWRSGBAGP-YBXAARCKSA-N
Molecular Weight 470.085 g/mol
SMILES [C@@]1([C@]([C@@](OC(=O)C)([C@](O[C@]1(Cl)[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(C(Cl)(Cl)Cl)=O)[H]
SPLASH splash10-014i-0923000000-e0bd9bfdfc38b94deedf
Source of Spectrum E1-40-3266-12
Synonyms 2,2,2-trichloroacetic acid [4,5-diacetyloxy-6-(acetyloxymethyl)-2-chloro-3-oxanyl] ester [4,5-diacetyloxy-6-(acetyloxymethyl)-2-chlorooxan-3-yl] 2,2,2-trichloroacetate [4,5-diacetoxy-6-(acetoxymethyl)-2-chloro-tetrahydropyran-3-yl] 2,2,2-trichloroacetate [4,5-diacetyloxy-6-(acetyloxymethyl)-2-chloranyl-oxan-3-yl] 2,2,2-tris(chloranyl)ethanoate
Wiley ID 1551781