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2-(4-bromanyl-5-oxidanylidene-2,3-diphenyl-thiophen-2-yl)-2-phenyl-ethanenitrile
SpectraBase Compound ID 68cOAV9W0v6
InChI InChI=1S/C24H16BrNOS/c25-22-21(18-12-6-2-7-13-18)24(28-23(22)27,19-14-8-3-9-15-19)20(16-26)17-10-4-1-5-11-17/h1-15,20H
InChIKey BVIQOEOLHHPAPU-UHFFFAOYSA-N
Mol Weight 446.36 g/mol
Molecular Formula C24H16BrNOS
Exact Mass 445.013598 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KfZkEXCuGip
Name 2-(4-bromanyl-5-oxidanylidene-2,3-diphenyl-thiophen-2-yl)-2-phenyl-ethanenitrile
CAS Registry Number 85661-06-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H16BrNOS
InChI InChI=1S/C24H16BrNOS/c25-22-21(18-12-6-2-7-13-18)24(28-23(22)27,19-14-8-3-9-15-19)20(16-26)17-10-4-1-5-11-17/h1-15,20H
InChIKey BVIQOEOLHHPAPU-UHFFFAOYSA-N
Molecular Weight 446.362 g/mol
SMILES C1(C(=C(Br)C(S1)=O)c1ccccc1)(C(C#N)c1ccccc1)c1ccccc1
SPLASH splash10-00ba-3349000000-7a2e6f67a21bbb19a051
Source of Spectrum Y-20-242-0
Synonyms 2-(4-bromo-5-keto-2,3-diphenyl-2-thienyl)-2-phenyl-acetonitrile 2-(4-bromo-5-oxo-2,3-diphenyl-2-thienyl)-2-phenyl-acetonitrile 2-(4-bromo-5-oxo-2,3-diphenyl-2-thiophenyl)-2-phenylacetonitrile 2-(4-bromo-5-oxo-2,3-diphenylthiophen-2-yl)-2-phenylacetonitrile
Wiley ID 1386355