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3-(2-PHENYLVINYL)-4,5-DICARBOMETHOXYISOTHIAZOLE
SpectraBase Compound ID GWoLRzI3gKB
InChI InChI=1S/C15H13NO4S/c1-19-14(17)12-11(16-21-13(12)15(18)20-2)9-8-10-6-4-3-5-7-10/h3-9H,1-2H3/b9-8+
InChIKey MECJNELMKABFID-CMDGGOBGSA-N
Mol Weight 303.33 g/mol
Molecular Formula C15H13NO4S
Exact Mass 303.056529 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5XfamX6Wcx9
Name 3-(2-PHENYLVINYL)-4,5-DICARBOMETHOXYISOTHIAZOLE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H13NO4S
InChI InChI=1S/C15H13NO4S/c1-19-14(17)12-11(16-21-13(12)15(18)20-2)9-8-10-6-4-3-5-7-10/h3-9H,1-2H3/b9-8+
InChIKey MECJNELMKABFID-CMDGGOBGSA-N
Instrument Name Varian XL-100
Literature Reference R.M.PATON, I.STOBIE, R.M.MORTIER (1983) Phosphorus and Sulfur: v.15, N2, 137-142.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d