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4-Benzylthio-3-(benzylthiocarbonyl)-2,2,5,5-tetramethyl-1-oxyl-2,5-dihydro-1H-pyryrrole radical
SpectraBase Compound ID KaBUvxa6eU9
InChI InChI=1S/C23H26NO2S2/c1-22(2)19(21(25)28-16-18-13-9-6-10-14-18)20(23(3,4)24(22)26)27-15-17-11-7-5-8-12-17/h5-14H,15-16H2,1-4H3/q-1
InChIKey NYBJVALHSQYUIS-UHFFFAOYSA-N
Mol Weight 412.59 g/mol
Molecular Formula C23H26NO2S2
Exact Mass 412.140496 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxpcEMr5IIj
Name 4-Benzylthio-3-(benzylthiocarbonyl)-2,2,5,5-tetramethyl-1-oxyl-2,5-dihydro-1H-pyryrrole radical
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Formula C23H26NO2S2
InChI InChI=1S/C23H26NO2S2/c1-22(2)19(21(25)28-16-18-13-9-6-10-14-18)20(23(3,4)24(22)26)27-15-17-11-7-5-8-12-17/h5-14H,15-16H2,1-4H3/q-1
InChIKey NYBJVALHSQYUIS-UHFFFAOYSA-N
Molecular Weight 412.586 g/mol
SMILES C1(=C(C(C)(C)N(C1(C)C)[O-])SCc1ccccc1)C(SCc1ccccc1)=O
SPLASH splash10-0006-9002000000-126ef32f5fc7e752bfad
Source of Spectrum SO-0-1479-9
Synonyms 4-Benzylthio-3-(benzylthiocarbonyl)-2,2,5,5-tetramethyl-1-oxyl-2,5-dihydro-1H-pyrrole radical
Wiley ID 875986