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5-TOSYL-(1,3)-DITHIOLO-[4,5-C]-PYRROLE-2-ONE
SpectraBase Compound ID Cx5qxT65OXi
InChI InChI=1S/C12H9NO3S3/c1-8-2-4-9(5-3-8)19(15,16)13-6-10-11(7-13)18-12(14)17-10/h2-7H,1H3
InChIKey AHPBQGAOWWFLQH-UHFFFAOYSA-N
Mol Weight 311.39 g/mol
Molecular Formula C12H9NO3S3
Exact Mass 310.974457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JqZDi0ydtAu
Name N-Tosyl-(1,3)-dithiolo[4,5-c]pyrrole-2-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9NO3S3
InChI InChI=1S/C12H9NO3S3/c1-8-2-4-9(5-3-8)19(15,16)13-6-10-11(7-13)18-12(14)17-10/h2-7H,1H3
InChIKey AHPBQGAOWWFLQH-UHFFFAOYSA-N
Instrument Name Finnegan MAT TSQ 700
Ionization Type EI positive ion
Literature Reference DOI 10.3762/bjoc.11.125
Molecular Weight 311.388 g/mol
SMILES C1(Sc2c(S1)c[n](c2)S(c1ccc(cc1)C)(=O)=O)=O
SPLASH splash10-06r6-9625000000-16ad90e99b3e1fb91eaf
Source of Spectrum BJO-11-SM7-6
Wiley ID 1851453