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Acetic acid, trifluoro-, [2,3,3a,9a-tetrahydro-6-oxo-3-[(trifluoroacetyl)oxy]-6H-furo[2',3':4,5]oxazolo[3,2-c]pyrimidin-2-yl]methyl ester, [2R-(2.alpha.,3.beta.,3a.beta.,9a.beta.)]-
SpectraBase Compound ID HXb55QTGAD4
InChI InChI=1S/C13H8F6N2O7/c14-12(15,16)9(23)25-3-4-6(27-10(24)13(17,18)19)7-8(26-4)21-2-1-5(22)20-11(21)28-7/h1-2,4,6-8H,3H2
InChIKey ROCUABAGGVSXCO-UHFFFAOYSA-N
Mol Weight 418.2 g/mol
Molecular Formula C13H8F6N2O7
Exact Mass 418.02357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FC5BhDDMKot
Name Acetic acid, trifluoro-, [2,3,3a,9a-tetrahydro-6-oxo-3-[(trifluoroacetyl)oxy]-6H-furo[2',3':4,5]oxazolo[3,2-c]pyrimidin-2-yl]methyl ester, [2R-(2.alpha.,3.beta.,3a.beta.,9a.beta.)]-
Alternate Name(s) (6-Oxo-3-[(trifluoroacetyl)oxy]-2,3,3a,9a-tetrahydro-6H-furo[2',3':4,5][1,3]oxazolo[3,2-a]pyrimidin-2-yl)methyl trifluoroacetate 2,2,2-trifluoroacetic acid [6-oxo-3-(2,2,2-trifluoro-1-oxoethoxy)-2,3,3a,9a-tetrahydrofuro[1,2]oxazolo[3,4-a]pyrimidin-2-yl]methyl ester [6-oxo-3-(2,2,2-trifluoroacetyl)oxy-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-2-yl]methyl 2,2,2-trifluoroacetate [6-oxo-3-(2,2,2-trifluoroacetyl)oxy-2,3,3a,9a-tetrahydrofuro[1,2]oxazolo[3,4-a]pyrimidin-2-yl]methyl 2,2,2-trifluoroacetate [6-oxidanylidene-3-[2,2,2-tris(fluoranyl)ethanoyloxy]-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-2-yl]methyl 2,2,2-tris(fluoranyl)ethanoate
CAS Registry Number 55319-77-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8F6N2O7
InChI InChI=1S/C13H8F6N2O7/c14-12(15,16)9(23)25-3-4-6(27-10(24)13(17,18)19)7-8(26-4)21-2-1-5(22)20-11(21)28-7/h1-2,4,6-8H,3H2
InChIKey ROCUABAGGVSXCO-UHFFFAOYSA-N
Molecular Weight 418.204 g/mol
SMILES C1=CN2C(=NC1=O)OC1C(C(COC(C(F)(F)F)=O)OC21)OC(C(F)(F)F)=O
SPLASH splash10-014j-9300000000-f3ac38a4395fc8281cc2
Source of Spectrum O-6-1258-3
Wiley ID 58576