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3-(5-bromo-1H-indol-3-yl)-4,4,4-trifluoro-3-hydroxy-butyric acid ethyl ester
SpectraBase Compound ID 5nLxEowmRN7
InChI InChI=1S/C14H13BrF3NO3/c1-2-22-12(20)6-13(21,14(16,17)18)10-7-19-11-4-3-8(15)5-9(10)11/h3-5,7,19,21H,2,6H2,1H3
InChIKey UUWUGOTZNRIOEO-UHFFFAOYSA-N
Mol Weight 380.16 g/mol
Molecular Formula C14H13BrF3NO3
Exact Mass 379.003091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcA1CZ4du7t
Name 3-(5-bromo-1H-indol-3-yl)-4,4,4-trifluoro-3-hydroxy-butyric acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13BrF3NO3
InChI InChI=1S/C14H13BrF3NO3/c1-2-22-12(20)6-13(21,14(16,17)18)10-7-19-11-4-3-8(15)5-9(10)11/h3-5,7,19,21H,2,6H2,1H3
InChIKey UUWUGOTZNRIOEO-UHFFFAOYSA-N
Molecular Weight 380.161 g/mol
SMILES [nH]1c2ccc(cc2c(C(CC(=O)OCC)(C(F)(F)F)O)c1)Br
SPLASH splash10-00di-0094000000-680d3a2cfb560a0ef979
Source of Spectrum KD-16-1553-2
Synonyms 3-(5-bromo-1H-indol-3-yl)-4,4,4-trifluoro-3-hydroxybutanoic acid ethyl ester Ethyl 3-(5-bromanyl-1H-indol-3-yl)-4,4,4-tris(fluoranyl)-3-oxidanyl-butanoate Ethyl 3-(5-bromo-1H-indol-3-yl)-4,4,4-trifluoro-3-hydroxy-butanoate
Wiley ID 1637606