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2-Propanone, 1,3-bis(5-phenyl-3H-1,2-dithiol-3-ylidene)-, (Z,Z)-
SpectraBase Compound ID 7UWTEiMqzNE
InChI InChI=1S/C21H14OS4/c22-17(11-18-13-20(25-23-18)15-7-3-1-4-8-15)12-19-14-21(26-24-19)16-9-5-2-6-10-16/h1-14H/b18-11-,19-12-
InChIKey GUBHCUCLPPGLLI-ZAORYEFMSA-N
Mol Weight 410.6 g/mol
Molecular Formula C21H14OS4
Exact Mass 409.99275 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8qYjsXISqkE
Name 2-Propanone, 1,3-bis(5-phenyl-3H-1,2-dithiol-3-ylidene)-, (Z,Z)-
Alternate Name(s) (1Z,3Z)-1,3-bis(5-phenyl-3H-1,2-dithiol-3-ylidene)-2-propanone 1,3-bis-(5-phenyl-1,2-dithiol-3-ylidene)-2-propanone 3H-1,2-dithiole, 2-propanone deriv.
CAS Registry Number 69856-50-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14OS4
InChI InChI=1S/C21H14OS4/c22-17(11-18-13-20(25-23-18)15-7-3-1-4-8-15)12-19-14-21(26-24-19)16-9-5-2-6-10-16/h1-14H/b18-11-,19-12-
InChIKey GUBHCUCLPPGLLI-ZAORYEFMSA-N
Molecular Weight 410.582 g/mol
SMILES C1(=C\C(=C\C(\C=C\2C=C(c3ccccc3)SS2)=O)SS1)c1ccccc1
SPLASH splash10-014i-0190300000-3fc927029bec74b4eb61
Source of Spectrum F-34-2178-0
Wiley ID 1373564