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2,5-Bis(4-nitro-phenyl)-1,4-dithiin

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2,5-Bis(4-nitro-phenyl)-1,4-dithiin
SpectraBase Compound ID Hr7tXnShRwl
InChI InChI=1S/C16H10N2O4S2/c19-17(20)13-5-1-11(2-6-13)15-9-24-16(10-23-15)12-3-7-14(8-4-12)18(21)22/h1-10H
InChIKey PTCJODTWSGSVEY-UHFFFAOYSA-N
Mol Weight 358.39 g/mol
Molecular Formula C16H10N2O4S2
Exact Mass 358.008199 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DXWt7zBT8Aa
Name 2,5-Bis(4-nitro-phenyl)-1,4-dithiin
CAS Registry Number 38172-60-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H10N2O4S2
InChI InChI=1S/C16H10N2O4S2/c19-17(20)13-5-1-11(2-6-13)15-9-24-16(10-23-15)12-3-7-14(8-4-12)18(21)22/h1-10H
InChIKey PTCJODTWSGSVEY-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference C.M. Buess, K.S. Narayanan, K.D.Berlin, Org. Magn. Resonance 691 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3