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2(S)-2-Hydroxy-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-butyn-1-yl (2S)-2-Methoxy-2-phenyltrifluoropropanoate
SpectraBase Compound ID J6FtzAbRjXX
InChI InChI=1S/C19H21F3O6/c1-5-17(24,14-11-27-16(2,3)28-14)12-26-15(23)18(25-4,19(20,21)22)13-9-7-6-8-10-13/h1,6-10,14,24H,11-12H2,2-4H3/t14-,17+,18?/m1/s1
InChIKey BFXYPIFLJWDLLL-NAVMLSPISA-N
Mol Weight 402.37 g/mol
Molecular Formula C19H21F3O6
Exact Mass 402.129023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNWq0uBuuKN
Name 2(S)-2-Hydroxy-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-butyn-1-yl (2S)-2-Methoxy-2-phenyltrifluoropropanoate
Alternate Name(s) 2(S)-2-Hydroxy-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-butyn-1-yl (2R)-2-methoxy-2-phenyl-trfluoropropanoate 1,2-Dideoxy-4,5-O-(1-methylethylidene)-3-C-{[(3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl)oxy]methyl}-D-threo-pent-1-ynitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21F3O6
InChI InChI=1S/C19H21F3O6/c1-5-17(24,14-11-27-16(2,3)28-14)12-26-15(23)18(25-4,19(20,21)22)13-9-7-6-8-10-13/h1,6-10,14,24H,11-12H2,2-4H3/t14-,17+,18?/m1/s1
InChIKey BFXYPIFLJWDLLL-NAVMLSPISA-N
Molecular Weight 402.366 g/mol
SMILES O[C@@](COC(C(C(F)(F)F)(c1ccccc1)OC)=O)([C@@]1(OC(C)(C)OC1)[H])C#C
SPLASH splash10-0udl-4900000000-7a41b3ef1c3e05c92b0f
Source of Spectrum F-48-643-22
Wiley ID 1370231