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5,5-DIMETHYL-2,3-OCTAHYDROBENZO-2,5-DIHYDROTHIOPHENE
SpectraBase Compound ID 3YcW1SrRUqw
InChI InChI=1S/C10H16S/c1-10(2)7-8-5-3-4-6-9(8)11-10/h7,9H,3-6H2,1-2H3
InChIKey UHJUPTZHSKOWQX-UHFFFAOYSA-N
Mol Weight 168.3 g/mol
Molecular Formula C10H16S
Exact Mass 168.097272 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7NNAFRoiKfj
Name 2,4,5,6,7,7-Hexahydro-2,2-dimethyl-benzothiophene
CAS Registry Number 42854-41-1
Comments BRUKER CXP-100
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H16S
InChI InChI=1S/C10H16S/c1-10(2)7-8-5-3-4-6-9(8)11-10/h7,9H,3-6H2,1-2H3
InChIKey UHJUPTZHSKOWQX-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