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2-(5-bromo-1H-indol-3-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol
SpectraBase Compound ID 5gmV3IhaPUX
InChI InChI=1S/C11H6BrF6NO/c12-5-1-2-8-6(3-5)7(4-19-8)9(20,10(13,14)15)11(16,17)18/h1-4,19-20H
InChIKey ITKCKSUEKJUWNP-UHFFFAOYSA-N
Mol Weight 362.07 g/mol
Molecular Formula C11H6BrF6NO
Exact Mass 360.953696 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NaIjRT3fJ7
Name 2-(5-bromo-1H-indol-3-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H6BrF6NO
InChI InChI=1S/C11H6BrF6NO/c12-5-1-2-8-6(3-5)7(4-19-8)9(20,10(13,14)15)11(16,17)18/h1-4,19-20H
InChIKey ITKCKSUEKJUWNP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.201100569
Molecular Weight 362.069 g/mol
SMILES [nH]1cc(C(C(F)(F)F)(C(F)(F)F)O)c2c1ccc(c2)Br
SPLASH splash10-0006-0962000000-97a6eeaf570c24c0f34d
Source of Spectrum CMC-7-910/SM1-2
Synonyms 2-(5-bromo-1H-indol-3-yl)-1,1,1,3,3,3-hexafluoro-2-propanol 2-(5-bromanyl-1H-indol-3-yl)-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-ol
Wiley ID 1771810