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3-(4-Amino-2,3,5,6-tetrafluorobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo[b]thiophene
SpectraBase Compound ID G8m84EHc8vJ
InChI InChI=1S/C21H11F4NO3S/c22-15-14(16(23)18(25)19(26)17(15)24)20(29)13-11-6-5-10(28)7-12(11)30-21(13)8-1-3-9(27)4-2-8/h1-7,27-28H,26H2
InChIKey DLMTVMUNZPMPCG-UHFFFAOYSA-N
Mol Weight 433.38 g/mol
Molecular Formula C21H11F4NO3S
Exact Mass 433.039577 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CMbnQlvYq5
Name 3-(4-Amino-2,3,5,6-tetrafluorobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo[b]thiophene
Alternate Name(s) (4-amino-2,3,5,6-tetrafluorophenyl)[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothien-3-yl]methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H11F4NO3S
InChI InChI=1S/C21H11F4NO3S/c22-15-14(16(23)18(25)19(26)17(15)24)20(29)13-11-6-5-10(28)7-12(11)30-21(13)8-1-3-9(27)4-2-8/h1-7,27-28H,26H2
InChIKey DLMTVMUNZPMPCG-UHFFFAOYSA-N
Molecular Weight 433.377 g/mol
SMILES Oc1cc2c(c(c(-c3ccc(cc3)O)s2)C(c2c(c(F)c(c(c2F)F)N)F)=O)cc1
SPLASH splash10-00lr-0040900000-dad3e4f15011819147ac
Source of Spectrum J-56-3132-23
Wiley ID 1382631