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3-Ethyl-2-isopropyl-1-thia-3-aza-cyclohexane
SpectraBase Compound ID BTPuPAdqXc3
InChI InChI=1S/C9H19NS/c1-4-10-6-5-7-11-9(10)8(2)3/h8-9H,4-7H2,1-3H3
InChIKey IDZDWNZOTOEQEG-UHFFFAOYSA-N
Mol Weight 173.32 g/mol
Molecular Formula C9H19NS
Exact Mass 173.123821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kk1F4R4dU0l
Name 3-Ethyl-2-isopropyl-1-thia-3-aza-cyclohexane
CAS Registry Number 76888-73-8
Comments IN CF2CL2/ACETONE EQUILIBRIUM BETWEEN ALL POSSIBLE CONFORMATIONS WITH 2(EQ)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H19NS
InChI InChI=1S/C9H19NS/c1-4-10-6-5-7-11-9(10)8(2)3/h8-9H,4-7H2,1-3H3
InChIKey IDZDWNZOTOEQEG-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference A.R. Katritzky, V. Baker, F. Brito-Palma, J. Chem. Soc. Perkin II 1746 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany