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Ethyl 2-hydroxy-4-phenyl-2-(1H-pyrrol-2-yl)butanoate
SpectraBase Compound ID 8qDoC7xaQeT
InChI InChI=1S/C16H19NO3/c1-2-20-15(18)16(19,14-9-6-12-17-14)11-10-13-7-4-3-5-8-13/h3-9,12,17,19H,2,10-11H2,1H3/t16-/m1/s1
InChIKey MNMBUVGBNOIUQB-MRXNPFEDSA-N
Mol Weight 273.33 g/mol
Molecular Formula C16H19NO3
Exact Mass 273.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jrl8aYYeoZn
Name Ethyl 2-hydroxy-4-phenyl-2-(1H-pyrrol-2-yl)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO3
InChI InChI=1S/C16H19NO3/c1-2-20-15(18)16(19,14-9-6-12-17-14)11-10-13-7-4-3-5-8-13/h3-9,12,17,19H,2,10-11H2,1H3/t16-/m1/s1
InChIKey MNMBUVGBNOIUQB-MRXNPFEDSA-N
Literature Reference DOI 10.1021/jo2010704
Molecular Weight 273.332 g/mol
SMILES [nH]1cccc1[C@@](C(OCC)=O)(CCc1ccccc1)O
SPLASH splash10-0f6x-8390000000-2102d24a319640051951
Source of Spectrum J-76-6291-3aq
Synonyms (R)-ethyl 2-hydroxy-4-phenyl-2-(1H-pyrrol-2-yl)butanoate (2R)-2-hydroxy-4-phenyl-2-(1H-pyrrol-2-yl)butanoic acid ethyl ester Ethyl (2R)-2-hydroxy-4-phenyl-2-(1H-pyrrol-2-yl)butanoate Ethyl (2R)-2-oxidanyl-4-phenyl-2-(1H-pyrrol-2-yl)butanoate
Wiley ID 1746795