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3-Isopropyl-4-phenyl-5-thia-3-aza-bicyclo(4.4.0.0/1,4/)decan-2-one

View entire compound with spectra: 1 NMR

3-Isopropyl-4-phenyl-5-thia-3-aza-bicyclo(4.4.0.0/1,4/)decan-2-one
SpectraBase Compound ID NLtPJnAqGU
InChI InChI=1S/C17H21NOS/c1-12(2)18-15(19)16-11-7-6-10-14(16)20-17(16,18)13-8-4-3-5-9-13/h3-5,8-9,12,14H,6-7,10-11H2,1-2H3
InChIKey QSGJGVOINAQNLX-UHFFFAOYSA-N
Mol Weight 287.42 g/mol
Molecular Formula C17H21NOS
Exact Mass 287.134385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7MF045kP2fF
Name 3-Isopropyl-4-phenyl-5-thia-3-aza-bicyclo(4.4.0.0/1,4/)decan-2-one
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H21NOS
InChI InChI=1S/C17H21NOS/c1-12(2)18-15(19)16-11-7-6-10-14(16)20-17(16,18)13-8-4-3-5-9-13/h3-5,8-9,12,14H,6-7,10-11H2,1-2H3
InChIKey QSGJGVOINAQNLX-UHFFFAOYSA-N
Literature Reference M. Sakamoto, T. Yanase, T. Fujita, J. Chem. Soc. Perkin I 403 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3