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2-Butyl-cis-3a,4,5,6,7,7a-hexahydro-benzothiazole
SpectraBase Compound ID 5VwADUZnr5x
InChI InChI=1S/C11H19NS/c1-2-3-8-11-12-9-6-4-5-7-10(9)13-11/h9-10H,2-8H2,1H3
InChIKey SIKMHNWZDGNNEZ-UHFFFAOYSA-N
Mol Weight 197.34 g/mol
Molecular Formula C11H19NS
Exact Mass 197.123821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 618C4XOchVA
Name 2-Butyl-cis-3a,4,5,6,7,7a-hexahydro-benzothiazole
CAS Registry Number 77469-28-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H19NS
InChI InChI=1S/C11H19NS/c1-2-3-8-11-12-9-6-4-5-7-10(9)13-11/h9-10H,2-8H2,1H3
InChIKey SIKMHNWZDGNNEZ-UHFFFAOYSA-N
Literature Reference R.C. Cambie, D. Chambers, P.S. Rutledge, J. Chem. Soc. Perkin I 40 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported