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5-(difluoromethyl)-1H-indole
SpectraBase Compound ID HhH4Ce4CmDi
InChI InChI=1S/C9H7F2N/c10-9(11)7-1-2-8-6(5-7)3-4-12-8/h1-5,9,12H
InChIKey OKAMMYAHLWEFBP-UHFFFAOYSA-N
Mol Weight 167.16 g/mol
Molecular Formula C9H7F2N
Exact Mass 167.054656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71LeGzIaIAR
Name 5-(difluoromethyl)-1H-indole
Alternate Name(s) 5-[bis(fluoranyl)methyl]-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7F2N
InChI InChI=1S/C9H7F2N/c10-9(11)7-1-2-8-6(5-7)3-4-12-8/h1-5,9,12H
InChIKey OKAMMYAHLWEFBP-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol5030037
Molecular Weight 167.159 g/mol
SMILES [nH]1c2ccc(cc2cc1)C(F)F
SPLASH splash10-014i-1900000000-8ca941269d326be0441f
Source of Spectrum A1-16-5984/SMS16-27
Wiley ID 1756183