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3-(1-PROPENYL)-4,5-DICARBOMETHOXYISOTHIAZOLE
SpectraBase Compound ID 443IFMksY6v
InChI InChI=1S/C10H11NO4S/c1-4-5-6-7(9(12)14-2)8(16-11-6)10(13)15-3/h4-5H,1-3H3/b5-4+
InChIKey OFJKKMMASQUIIC-SNAWJCMRSA-N
Mol Weight 241.26 g/mol
Molecular Formula C10H11NO4S
Exact Mass 241.040879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fduz3hfLXS4
Name 3-(1-PROPENYL)-4,5-DICARBOMETHOXYISOTHIAZOLE
Comments 00
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H11NO4S
InChI InChI=1S/C10H11NO4S/c1-4-5-6-7(9(12)14-2)8(16-11-6)10(13)15-3/h4-5H,1-3H3/b5-4+
InChIKey OFJKKMMASQUIIC-SNAWJCMRSA-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