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Methyl-2,3,4-tri-O-trifluoracetyl.beta.d-xylopyranoside
SpectraBase Compound ID Jw88JerFpKE
InChI InChI=1S/C12H9F9O8/c1-25-6-5(29-9(24)12(19,20)21)4(28-8(23)11(16,17)18)3(2-26-6)27-7(22)10(13,14)15/h3-6H,2H2,1H3/t3-,4+,5-,6-/m1/s1
InChIKey DSZMRTJLRNFUPV-JGWLITMVSA-N
Mol Weight 452.18 g/mol
Molecular Formula C12H9F9O8
Exact Mass 452.015371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Itf9fuPZ6m2
Name Methyl-2,3,4-tri-O-trifluoracetyl.beta.d-xylopyranoside
Alternate Name(s) 2,2,2-trifluoroacetic acid [6-methoxy-4,5-bis(2,2,2-trifluoro-1-oxoethoxy)-3-oxanyl] ester [6-methoxy-4,5-bis[(2,2,2-trifluoroacetyl)oxy]oxan-3-yl] 2,2,2-trifluoroacetate [6-methoxy-4,5-bis[(2,2,2-trifluoroacetyl)oxy]tetrahydropyran-3-yl] 2,2,2-trifluoroacetate [6-methoxy-4,5-bis[2,2,2-tris(fluoranyl)ethanoyloxy]oxan-3-yl] 2,2,2-tris(fluoranyl)ethanoate
CAS Registry Number 28034-59-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9F9O8
InChI InChI=1S/C12H9F9O8/c1-25-6-5(29-9(24)12(19,20)21)4(28-8(23)11(16,17)18)3(2-26-6)27-7(22)10(13,14)15/h3-6H,2H2,1H3/t3-,4+,5-,6-/m1/s1
InChIKey DSZMRTJLRNFUPV-JGWLITMVSA-N
Molecular Weight 452.182 g/mol
SMILES [C@]1([C@](OC(C(F)(F)F)=O)([C@]([C@@](CO1)(OC(=O)C(F)(F)F)[H])(OC(C(F)(F)F)=O)[H])[H])(OC)[H]
SPLASH splash10-00or-3940000000-5c00b891e548e6aaa92d
Source of Spectrum NP-15-3053-0
Wiley ID 1112417