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cis-3-H,3a-H-2-Carbamoyl-3-phenyl-2,3,3a,4-tetra hydro(1)benzothiapyrano(4,3-C)pyrazole

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cis-3-H,3a-H-2-Carbamoyl-3-phenyl-2,3,3a,4-tetra hydro(1)benzothiapyrano(4,3-C)pyrazole
SpectraBase Compound ID IRP17t6L7Is
InChI InChI=1S/C17H15N3OS/c18-17(21)20-16(11-6-2-1-3-7-11)13-10-22-14-9-5-4-8-12(14)15(13)19-20/h1-9,13,16H,10H2,(H2,18,21)
InChIKey UWDGZLVIPODGSF-UHFFFAOYSA-N
Mol Weight 309.39 g/mol
Molecular Formula C17H15N3OS
Exact Mass 309.093583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDWhO8nGa2D
Name cis-3-H,3a-H-2-Carbamoyl-3-phenyl-2,3,3a,4-tetra hydro(1)benzothiapyrano(4,3-C)pyrazole
Comments BRUKER AM-400 OR AC-250 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H15N3OS
InChI InChI=1S/C17H15N3OS/c18-17(21)20-16(11-6-2-1-3-7-11)13-10-22-14-9-5-4-8-12(14)15(13)19-20/h1-9,13,16H,10H2,(H2,18,21)
InChIKey UWDGZLVIPODGSF-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference G. Toth, A. Szoelloesy, T. Lorand, J. Chem. Soc. Perkin II 319 (1989).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6