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3-Mesityl-chromeno(4,3-C)isothiazol-4-one
SpectraBase Compound ID CppoM9kglDp
InChI InChI=1S/C19H15NO2S/c1-10-8-11(2)15(12(3)9-10)18-16-17(20-23-18)13-6-4-5-7-14(13)22-19(16)21/h4-9H,1-3H3
InChIKey VLILSCADKQBGNP-UHFFFAOYSA-N
Mol Weight 321.39 g/mol
Molecular Formula C19H15NO2S
Exact Mass 321.08235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 65tM6nndBfu
Name 3-Mesityl-chromeno(4,3-C)isothiazol-4-one
CAS Registry Number 124213-83-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H15NO2S
InChI InChI=1S/C19H15NO2S/c1-10-8-11(2)15(12(3)9-10)18-16-17(20-23-18)13-6-4-5-7-14(13)22-19(16)21/h4-9H,1-3H3
InChIKey VLILSCADKQBGNP-UHFFFAOYSA-N
Literature Reference P.A. Brownsort, R.M. Paton, J. Chem. Soc. Perkin I 1679 (1989).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3