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Ethyl 3-benzyl-4-oxo-2-thioxo-1,3-thiazolane-5-carboxylate
SpectraBase Compound ID 6h6kgdeaZyY
InChI InChI=1S/C13H13NO3S2/c1-2-17-12(16)10-11(15)14(13(18)19-10)8-9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3
InChIKey BSUYTFDUODEHNC-UHFFFAOYSA-N
Mol Weight 295.37 g/mol
Molecular Formula C13H13NO3S2
Exact Mass 295.033686 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3C5AsdiIu3
Name ETHYL-3-BENZYL-4-OXO-2-THIOXO-1,3-THIAZOLANE-5-CARBOXYLATE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13NO3S2
InChI InChI=1S/C13H13NO3S2/c1-2-17-12(16)10-11(15)14(13(18)19-10)8-9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3
InChIKey BSUYTFDUODEHNC-UHFFFAOYSA-N
Literature Reference Author I.YAVARI,R.HAJINASIRI,S.SAYED-ALANGI,N.IRAVANI
Literature Reference Citation MH.CHEM.,139,1029(2008)
Literature Reference DOI 10.1007/s00706-008-0900-x
Molecular Weight 295.371 g/mol
Sample ID 40015
Solvent CDCl3