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3-[4-Aminobenzoyl]-6-hydroxy-2-(4-hydroxyphenyl)benzo[b]thiophene
SpectraBase Compound ID CRpVAeQkZvG
InChI InChI=1S/C21H15NO3S/c22-14-5-1-12(2-6-14)20(25)19-17-10-9-16(24)11-18(17)26-21(19)13-3-7-15(23)8-4-13/h1-11,23-24H,22H2
InChIKey YUPKUWBDLQWKKJ-UHFFFAOYSA-N
Mol Weight 361.42 g/mol
Molecular Formula C21H15NO3S
Exact Mass 361.077265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FGiXLOPPlbB
Name 3-[4-Aminobenzoyl]-6-hydroxy-2-(4-hydroxyphenyl)benzo[b]thiophene
Alternate Name(s) (4-aminophenyl)[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothien-3-yl]methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15NO3S
InChI InChI=1S/C21H15NO3S/c22-14-5-1-12(2-6-14)20(25)19-17-10-9-16(24)11-18(17)26-21(19)13-3-7-15(23)8-4-13/h1-11,23-24H,22H2
InChIKey YUPKUWBDLQWKKJ-UHFFFAOYSA-N
Molecular Weight 361.415 g/mol
SMILES Oc1cc2c(c(c(-c3ccc(cc3)O)s2)C(c2ccc(cc2)N)=O)cc1
SPLASH splash10-03k9-4619000000-753e512744232c43bc1c
Source of Spectrum J-56-3131-8
Wiley ID 1349027