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TETRAHYDRO-3H,4H-3a,8a-(METHANOTHIOMETHANO)-1H-CYCLOHEPTA[c]THIOPHENE
SpectraBase Compound ID B6F8GAevp0x
InChI InChI=1S/C11H18S2/c1-2-4-10-6-12-8-11(10,5-3-1)9-13-7-10/h1-9H2
InChIKey WMMMFSIBAJPITH-UHFFFAOYSA-N
Mol Weight 214.38 g/mol
Molecular Formula C11H18S2
Exact Mass 214.084993 g/mol

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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID rJfDTb3WSO
Name TETRAHYDRO-3H,4H-3a,8a-(METHANOTHIOMETHANO)-1H-CYCLOHEPTA[c]THIOPHENE
Source of Sample K. Weinges, H. Baake Chem. Ber. 110, 2978(1977)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18S2
InChI InChI=1S/C11H18S2/c1-2-4-10-6-12-8-11(10,5-3-1)9-13-7-10/h1-9H2
InChIKey WMMMFSIBAJPITH-UHFFFAOYSA-N
Molecular Weight 214.39
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker HX-90
Synonyms DITHIA/5.3.3/PROPELLANE, 9,12-, /METHANOTHIOMETHANO/-1H-CYCLOHEPTA/C/THIOPHENE, 3H,4H-3A,8A-, TETRAHYDRO-,