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Acetic acid, trifluoro-, 2-[(acetyloxy)methyl]-2,3,3a,9a-tetrahydro-6-oxo-6H-furo[2',3':4,5]oxazolo[3,2-a]pyrimidin-3-yl ester, [2R-(2.alpha.,3.beta.,3a.beta.,9a.beta.)]-
SpectraBase Compound ID LAGQ2y8niOD
InChI InChI=1S/C13H11F3N2O7/c1-5(19)22-4-6-8(24-11(21)13(14,15)16)9-10(23-6)18-3-2-7(20)17-12(18)25-9/h2-3,6,8-10H,4H2,1H3
InChIKey XFBBTYXFRGXJNK-UHFFFAOYSA-N
Mol Weight 364.23 g/mol
Molecular Formula C13H11F3N2O7
Exact Mass 364.051835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L2wenKQoAOa
Name Acetic acid, trifluoro-, 2-[(acetyloxy)methyl]-2,3,3a,9a-tetrahydro-6-oxo-6H-furo[2',3':4,5]oxazolo[3,2-a]pyrimidin-3-yl ester, [2R-(2.alpha.,3.beta.,3a.beta.,9a.beta.)]-
CAS Registry Number 40732-63-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11F3N2O7
InChI InChI=1S/C13H11F3N2O7/c1-5(19)22-4-6-8(24-11(21)13(14,15)16)9-10(23-6)18-3-2-7(20)17-12(18)25-9/h2-3,6,8-10H,4H2,1H3
InChIKey XFBBTYXFRGXJNK-UHFFFAOYSA-N
Molecular Weight 364.233 g/mol
SMILES CC(=O)OCC1C(C2C(N3C=CC(N=C3O2)=O)O1)OC(C(F)(F)F)=O
SPLASH splash10-02t9-9812000000-18647a26ac7ea7511b58
Source of Spectrum W5-1989-57845-7691
Synonyms 2-[(Acetyloxy)methyl]-6-oxo-2,3,3a,9a-tetrahydro-6H-furo[2',3':4,5][1,3]oxazolo[3,2-a]pyrimidin-3-yl trifluoroacetate 2,2,2-trifluoroacetic acid [2-(acetyloxymethyl)-6-oxo-2,3,3a,9a-tetrahydrofuro[1,2]oxazolo[3,4-a]pyrimidin-3-yl] ester [2-(acetyloxymethyl)-6-oxo-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-3-yl] 2,2,2-trifluoroacetate [2-(acetoxymethyl)-6-oxo-2,3,3a,9a-tetrahydrofuro[1,2]oxazolo[3,4-a]pyrimidin-3-yl] 2,2,2-trifluoroacetate [2-(acetyloxymethyl)-6-oxidanylidene-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-3-yl] 2,2,2-tris(fluoranyl)ethanoate
Wiley ID 1350474