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cis-1,3,3a,4,5,7a-Hexahydro-2-benzothiophene

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cis-1,3,3a,4,5,7a-Hexahydro-2-benzothiophene
SpectraBase Compound ID ISE5BfZ6e6P
InChI InChI=1S/C8H12S/c1-2-4-8-6-9-5-7(8)3-1/h1,3,7-8H,2,4-6H2
InChIKey VSHDCCCBMIRYIB-UHFFFAOYSA-N
Mol Weight 140.24 g/mol
Molecular Formula C8H12S
Exact Mass 140.065972 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K0cp8ajEEV7
Name trans-1,3,3a,4,5,7a-Hexahydro-2-benzothiophene
Comments from mixture
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H12S
InChI InChI=1S/C8H12S/c1-2-4-8-6-9-5-7(8)3-1/h1,3,7-8H,2,4-6H2
InChIKey VSHDCCCBMIRYIB-UHFFFAOYSA-N
Literature Reference K. Harano, K. Ono, M. Nishimoto, Tetrahedron Lett. 2387 (1991).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported