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Ethyl 4,4,4-trifluoro-2-hydroxy-2-(hydroxyphenylmethyl)butanoate isomer
SpectraBase Compound ID 7fCxIrzduft
InChI InChI=1S/C13H15F3O4/c1-2-20-11(18)12(19,8-13(14,15)16)7-9-3-5-10(17)6-4-9/h3-6,17,19H,2,7-8H2,1H3
InChIKey CRJMZDGSGANOHS-UHFFFAOYSA-N
Mol Weight 292.25 g/mol
Molecular Formula C13H15F3O4
Exact Mass 292.092243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BAQcHIZE0c
Name Ethyl 4,4,4-trifluoro-2-hydroxy-2-(hydroxyphenylmethyl)butanoate isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15F3O4
InChI InChI=1S/C13H15F3O4/c1-2-20-11(18)12(19,8-13(14,15)16)7-9-3-5-10(17)6-4-9/h3-6,17,19H,2,7-8H2,1H3
InChIKey CRJMZDGSGANOHS-UHFFFAOYSA-N
Molecular Weight 292.254 g/mol
SMILES Oc1ccc(CC(CC(F)(F)F)(C(=O)OCC)O)cc1
SPLASH splash10-001i-9200000000-a523ffbed72195f517e7
Source of Spectrum KC-61-10214-0
Wiley ID 1630966