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5-SPIRO-CYCLOHEXYL-3-CARBOMETHOXY-2,5-DIHYDROTHIOPHENE
SpectraBase Compound ID KRahiD4MHFE
InChI InChI=1S/C11H16O2S/c1-13-10(12)9-7-11(14-8-9)5-3-2-4-6-11/h7H,2-6,8H2,1H3
InChIKey NXDCUPCMUJGFQQ-UHFFFAOYSA-N
Mol Weight 212.31 g/mol
Molecular Formula C11H16O2S
Exact Mass 212.087101 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LEeK79wYZji
Name 1-Thia-spiro(4.5)dec-3-ene-3-carboxylic acid, methyl ester
CAS Registry Number 66982-55-6
Comments BRUKER CXP-100
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H16O2S
InChI InChI=1S/C11H16O2S/c1-13-10(12)9-7-11(14-8-9)5-3-2-4-6-11/h7H,2-6,8H2,1H3
InChIKey NXDCUPCMUJGFQQ-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference J. Mc Intosh, Can. J. Chem. 57, 131 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3