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3,7-BIS(DIMETHYLAMINO)-1,5,2,4,6,8-DITHIA(5-SIV)TETRAZOCINE

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3,7-BIS(DIMETHYLAMINO)-1,5,2,4,6,8-DITHIA(5-SIV)TETRAZOCINE
SpectraBase Compound ID KxNcLoiFL3f
InChI InChI=1S/C6H12N6S2/c1-11(2)5-7-13-9-6(12(3)4)10-14-8-5/h1-4H3/b7-5+,9-6+
InChIKey HTEHPARZTNJJHE-PDTNFJSOSA-N
Mol Weight 232.32 g/mol
Molecular Formula C6H12N6S2
Exact Mass 232.056487 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2lQwfdgkRbc
Name 3,7-BIS(DIMETHYLAMINO)-1,5,2,4,6,8-DITHIA(5-SIV)TETRAZOCINE
Source of Sample I. Ernest, W. Holick, G. Rihs J. Amer. Chem. Soc. 103, 1540(1981)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12N6S2
InChI InChI=1S/C6H12N6S2/c1-11(2)5-7-13-9-6(12(3)4)10-14-8-5/h1-4H3/b7-5+,9-6+
InChIKey HTEHPARZTNJJHE-PDTNFJSOSA-N
Molecular Weight 232.33
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian XL-100
Synonyms DITHIA/5-S