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Dimethyl cis, cis-3,8-dihydro-6-(1-pyrrolidinyl)-2H-thiocin-4,5-dicarboxylate

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Dimethyl cis, cis-3,8-dihydro-6-(1-pyrrolidinyl)-2H-thiocin-4,5-dicarboxylate
SpectraBase Compound ID KSaT0yVOcEp
InChI InChI=1S/C15H21NO4S/c1-19-14(17)11-5-9-21-10-6-12(13(11)15(18)20-2)16-7-3-4-8-16/h6H,3-5,7-10H2,1-2H3/b12-6+,13-11-
InChIKey QERQGESPYZXVHJ-BLZREXABSA-N
Mol Weight 311.4 g/mol
Molecular Formula C15H21NO4S
Exact Mass 311.119129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 55ubdkzbaw6
Name Dimethyl cis, cis-3,8-dihydro-6-(1-pyrrolidinyl)-2H-thiocin-4,5-dicarboxylate
CAS Registry Number 83585-92-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H21NO4S
InChI InChI=1S/C15H21NO4S/c1-19-14(17)11-5-9-21-10-6-12(13(11)15(18)20-2)16-7-3-4-8-16/h6H,3-5,7-10H2,1-2H3/b12-6+,13-11-
InChIKey QERQGESPYZXVHJ-BLZREXABSA-N
Instrument Name Varian XL-100
Literature Reference D.N. Reinhoudt, W. Verboom, G.W. Visser, J. Am. Chem. Soc. 106, 1431 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3