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1,4-bis[3'-(Phenylthio)-3'-butene-2'-on-4'-yl]benzene
SpectraBase Compound ID GtA8lsWMF4s
InChI InChI=1S/C26H22O2S2/c1-19(27)25(29-23-9-5-3-6-10-23)17-21-13-15-22(16-14-21)18-26(20(2)28)30-24-11-7-4-8-12-24/h3-18H,1-2H3/b25-17-,26-18-
InChIKey JKEOXOCTHUTUCC-MFYXSQMNSA-N
Mol Weight 430.58 g/mol
Molecular Formula C26H22O2S2
Exact Mass 430.106122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3VAQVPFqvZA
Name 1,4-bis[3'-(Phenylthio)-3'-butene-2'-on-4'-yl]benzene
Alternate Name(s) (3Z)-4-{4-[(1Z)-3-oxo-2-(phenylsulfanyl)-1-butenyl]phenyl}-3-(phenylsulfanyl)-3-buten-2-one
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Formula C26H22O2S2
InChI InChI=1S/C26H22O2S2/c1-19(27)25(29-23-9-5-3-6-10-23)17-21-13-15-22(16-14-21)18-26(20(2)28)30-24-11-7-4-8-12-24/h3-18H,1-2H3/b25-17-,26-18-
InChIKey JKEOXOCTHUTUCC-MFYXSQMNSA-N
Molecular Weight 430.580 g/mol
SMILES c1(\C=C\(Sc2ccccc2)C(=O)C)ccc(\C=C\(Sc2ccccc2)C(=O)C)cc1
SPLASH splash10-001i-4391200000-3e94a56249dba0df8836
Source of Spectrum AH-130-553-5
Wiley ID 770637