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2-(N,N-DIMETHYL)-IMINO-5,5-DIOXOPERHYDROTHIENO-[3.4-D]-1,3-DIOTHIOLAN_BROMIDE
SpectraBase Compound ID CKkLDx1nmQQ
InChI InChI=1S/C7H12NO2S3.BrH/c1-8(2)7-11-5-3-13(9,10)4-6(5)12-7;/h5-6H,3-4H2,1-2H3;1H/q+1;/p-1
InChIKey PFWQFBAUTBYOSB-UHFFFAOYSA-M
Mol Weight 318.26 g/mol
Molecular Formula C7H12BrNO2S3
Exact Mass 316.921355 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L4AKcXW8Zly
Name 2-(N,N-DIMETHYL)-IMINO-5,5-DIOXOPERHYDROTHIENO-[3.4-D]-1,3-DIOTHIOLAN_BROMIDE
Compound Number IA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12BrNO2S3
InChI InChI=1S/C7H12NO2S3.BrH/c1-8(2)7-11-5-3-13(9,10)4-6(5)12-7;/h5-6H,3-4H2,1-2H3;1H/q+1;/p-1
InChIKey PFWQFBAUTBYOSB-UHFFFAOYSA-M
Literature Reference Author V.I.SLUTSKII,Y.B.BEZUGLYI
Literature Reference Citation CHEM.HET.COMP.,29,33(1993)
Literature Reference DOI 10.1007/bf00528633
Molecular Weight 318.262 g/mol
Solvent ACETONE-D6:H2O
Source File Reference UWMZ12368