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3-chloro-N2,N6-diphenyl-benzothiophene-2,6-dicarboxamide
SpectraBase Compound ID Jpx8ACTUF2n
InChI InChI=1S/C22H15ClN2O2S/c23-19-17-12-11-14(21(26)24-15-7-3-1-4-8-15)13-18(17)28-20(19)22(27)25-16-9-5-2-6-10-16/h1-13H,(H,24,26)(H,25,27)
InChIKey QBUDNEDWPGHPBF-UHFFFAOYSA-N
Mol Weight 406.89 g/mol
Molecular Formula C22H15ClN2O2S
Exact Mass 406.054277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID NY5oDZd4HS
Name 3-chloro-N2,N6-diphenyl-benzothiophene-2,6-dicarboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H15ClN2O2S
InChI InChI=1S/C22H15ClN2O2S/c23-19-17-12-11-14(21(26)24-15-7-3-1-4-8-15)13-18(17)28-20(19)22(27)25-16-9-5-2-6-10-16/h1-13H,(H,24,26)(H,25,27)
InChIKey QBUDNEDWPGHPBF-UHFFFAOYSA-N
Instrument Name Shimadzu QP-5000
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290090406
Molecular Weight 406.887 g/mol
SMILES N(C(c1ccc2c(sc(C(Nc3ccccc3)=O)c2Cl)c1)=O)c1ccccc1
SPLASH splash10-01ox-2905000000-d90ca0dc347df156debb
Source of Spectrum RCM-9-284-2
Wiley ID 1835837