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6-(p-t-Butylphenyl)-2-thioxo-6H-[1,3]dithiolo[4',5':5,6]dithino[2,3-c][1,4]pyrrole-5,7-dione
SpectraBase Compound ID IGLNhPHqivN
InChI InChI=1S/C17H13NO2S5/c1-17(2,3)8-4-6-9(7-5-8)18-12(19)10-11(13(18)20)23-15-14(22-10)24-16(21)25-15/h4-7H,1-3H3
InChIKey MSUVNEAJHNHFRU-UHFFFAOYSA-N
Mol Weight 423.6 g/mol
Molecular Formula C17H13NO2S5
Exact Mass 422.954985 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID O0eeH5Iqu
Name 6-(p-t-Butylphenyl)-2-thioxo-6H-[1,3]dithiolo[4',5':5,6]dithino[2,3-c][1,4]pyrrole-5,7-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13NO2S5
InChI InChI=1S/C17H13NO2S5/c1-17(2,3)8-4-6-9(7-5-8)18-12(19)10-11(13(18)20)23-15-14(22-10)24-16(21)25-15/h4-7H,1-3H3
InChIKey MSUVNEAJHNHFRU-UHFFFAOYSA-N
Molecular Weight 423.596 g/mol
SMILES C12=C(C(=O)N(C2=O)c2ccc(C(C)(C)C)cc2)SC=2SC(SC2S1)=S
SPLASH splash10-05fr-0000900000-c8c495846e9a2adc1b5d
Source of Spectrum KC-1992-1809-6
Wiley ID 776607