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Ethyl 2-(3,5-difluorophenyl)-2-hydroxy-2-(1H-pyrrol-2-yl)acetate
SpectraBase Compound ID 2hXN9FC12lD
InChI InChI=1S/C14H13F2NO3/c1-2-20-13(18)14(19,12-4-3-5-17-12)9-6-10(15)8-11(16)7-9/h3-8,17,19H,2H2,1H3/t14-/m1/s1
InChIKey LUJWEKOSPXFELI-CQSZACIVSA-N
Mol Weight 281.26 g/mol
Molecular Formula C14H13F2NO3
Exact Mass 281.08635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LSwISDOP5hp
Name Ethyl 2-(3,5-difluorophenyl)-2-hydroxy-2-(1H-pyrrol-2-yl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13F2NO3
InChI InChI=1S/C14H13F2NO3/c1-2-20-13(18)14(19,12-4-3-5-17-12)9-6-10(15)8-11(16)7-9/h3-8,17,19H,2H2,1H3/t14-/m1/s1
InChIKey LUJWEKOSPXFELI-CQSZACIVSA-N
Literature Reference DOI 10.1021/jo2010704
Molecular Weight 281.259 g/mol
SMILES [nH]1cccc1[C@@](C(OCC)=O)(c1cc(cc(c1)F)F)O
SPLASH splash10-0a4l-0590000000-705f9833557233fdf877
Source of Spectrum J-76-6291-3am
Synonyms (R)-ethyl 2-(3,5-difluorophenyl)-2-hydroxy-2-(1H-pyrrol-2-yl)acetate Ethyl (2R)-2-(3,5-difluorophenyl)-2-hydroxy-2-(1H-pyrrol-2-yl)acetate Ethyl (2R)-2-[3,5-bis(fluoranyl)phenyl]-2-oxidanyl-2-(1H-pyrrol-2-yl)ethanoate
Wiley ID 1746791