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Methyl-sinharine

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Methyl-sinharine
SpectraBase Compound ID 37lBodgTeNr
InChI InChI=1S/C13H17NOS/c1-14(10-11-16-2)13(15)9-8-12-6-4-3-5-7-12/h3-9H,10-11H2,1-2H3/b9-8+
InChIKey XFYGGQGDUBKTFT-CMDGGOBGSA-N
Mol Weight 235.34 g/mol
Molecular Formula C13H17NOS
Exact Mass 235.103085 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KtzZTTet9K
Name Methyl-sinharine
Comments CONFORMER 1, C1-C5 SIGNALS COULD BE CHANGED WITH CONFORMER 2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17NOS
InChI InChI=1S/C13H17NOS/c1-14(10-11-16-2)13(15)9-8-12-6-4-3-5-7-12/h3-9H,10-11H2,1-2H3/b9-8+
InChIKey XFYGGQGDUBKTFT-CMDGGOBGSA-N
Instrument Name Bruker AM-400
Literature Reference H. Greger, O. Hofer, H. Kaehlig, Tetrahedron 48, 1209 (1992).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3