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4-Methoxy-isomazole

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4-Methoxy-isomazole
SpectraBase Compound ID Ii6bqjuwN56
InChI InChI=1S/C15H15N3O3S/c1-20-12-8-9(22(3)19)4-5-10(12)14-17-11-6-7-16-15(21-2)13(11)18-14/h4-8H,1-3H3,(H,17,18)
InChIKey LFILHNZRWSZVFG-UHFFFAOYSA-N
Mol Weight 317.36 g/mol
Molecular Formula C15H15N3O3S
Exact Mass 317.083413 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HXirR994ZFU
Name 4-Methoxy-isomazole
Comments BRUKER AM-200 OR WM-360 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H15N3O3S
InChI InChI=1S/C15H15N3O3S/c1-20-12-8-9(22(3)19)4-5-10(12)14-17-11-6-7-16-15(21-2)13(11)18-14/h4-8H,1-3H3,(H,17,18)
InChIKey LFILHNZRWSZVFG-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference J.C. Lindon, J.M. Williams, P. Barraclough, Magn. Res. Chem. 28, 573 (1990).
NMR Standard Dioxane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O