SpectraBase Compound ID | CsKjy7Lg3oj |
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InChI | InChI=1S/C6H12S/c1-6-3-2-4-7-5-6/h6H,2-5H2,1H3 |
InChIKey | WTPRCAYZVQKROM-UHFFFAOYSA-N |
Mol Weight | 116.22 g/mol |
Molecular Formula | C6H12S |
Exact Mass | 116.065972 g/mol |
SpectraBase Spectrum ID | Y3DdyhFOpB |
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Name | 3-Methyl-thiane |
CAS Registry Number | 5258-50-4 |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C6H12S |
InChI | InChI=1S/C6H12S/c1-6-3-2-4-7-5-6/h6H,2-5H2,1H3 |
InChIKey | WTPRCAYZVQKROM-UHFFFAOYSA-N |
Instrument Name | Varian XL-100 |
Literature Reference | G. Barbarella, P. Dembech, A. Garbesi, Org. Magn. Resonance 8, 469 (1976). |
NMR Standard | TMS |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | CDCl3 |