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2-Propanone, 1,3-bis[5-(4-bromophenyl)-3H-1,2-dithiol-3-ylidene]-, (Z,Z)-
SpectraBase Compound ID LkLvLCYdPWn
InChI InChI=1S/C21H12Br2OS4/c22-15-5-1-13(2-6-15)20-11-18(25-27-20)9-17(24)10-19-12-21(28-26-19)14-3-7-16(23)8-4-14/h1-12H/b18-9-,19-10-
InChIKey LNVDXUCRPACJJA-JZAWIKSFSA-N
Mol Weight 568.4 g/mol
Molecular Formula C21H12Br2OS4
Exact Mass 565.813776 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KQCjX8BpP3L
Name 2-Propanone, 1,3-bis[5-(4-bromophenyl)-3H-1,2-dithiol-3-ylidene]-, (Z,Z)-
CAS Registry Number 69856-51-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H12Br2OS4
InChI InChI=1S/C21H12Br2OS4/c22-15-5-1-13(2-6-15)20-11-18(25-27-20)9-17(24)10-19-12-21(28-26-19)14-3-7-16(23)8-4-14/h1-12H/b18-9-,19-10-
InChIKey LNVDXUCRPACJJA-JZAWIKSFSA-N
Molecular Weight 568.374 g/mol
SMILES C1(=C\C(=C\C(\C=C\2C=C(c3ccc(cc3)Br)SS2)=O)SS1)c1ccc(cc1)Br
SPLASH splash10-00kb-0060090000-9b853fc16b1fb5f0c774
Source of Spectrum F-34-2178-0
Synonyms (1Z,3Z)-1,3-bis[5-(4-bromophenyl)-3H-1,2-dithiol-3-ylidene]-2-propanone 1,3-bis-(5-p-bromophenyl-1,2-dithiol-3-ylidene)-2-propanone 3H-1,2-dithiole, 2-propanone deriv.
Wiley ID 1407264