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1-Thiocarbamoyl-3-tert.-butyl-3a,8b-dihydro-8b-hydroxy-indeno-[1,2-C]-pyrazol-4-one
SpectraBase Compound ID 29273rvtrVT
InChI InChI=1S/C15H17N3O2S/c1-14(2,3)12-10-11(19)8-6-4-5-7-9(8)15(10,20)18(17-12)13(16)21/h4-7,10,20H,1-3H3,(H2,16,21)
InChIKey HJCSVZBFDGTPSN-UHFFFAOYSA-N
Mol Weight 303.38 g/mol
Molecular Formula C15H17N3O2S
Exact Mass 303.104148 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5v2SuNg0lmy
Name 1-Thiocarbamoyl-3-tert.-butyl-3a,8b-dihydro-8b-hydroxy-indeno-[1,2-C]-pyrazol-4-one
CAS Registry Number 87206-97-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H17N3O2S
InChI InChI=1S/C15H17N3O2S/c1-14(2,3)12-10-11(19)8-6-4-5-7-9(8)15(10,20)18(17-12)13(16)21/h4-7,10,20H,1-3H3,(H2,16,21)
InChIKey HJCSVZBFDGTPSN-UHFFFAOYSA-N
Instrument Name SF = 080 MHz
Literature Reference J. Org. Chem. 48, 4326 (1983).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3