SpectraBase Compound ID | B4KuWlBA8eN |
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InChI | InChI=1S/C13H16O3S/c14-13-9-5-4-6-11(13)10-17(15,16)12-7-2-1-3-8-12/h1-3,7-8,10,13-14H,4-6,9H2/b11-10+ |
InChIKey | FVQWQGUAFYQMRX-ZHACJKMWSA-N |
Mol Weight | 252.33 g/mol |
Molecular Formula | C13H16O3S |
Exact Mass | 252.082016 g/mol |
SpectraBase Spectrum ID | 9Ho8wmr7dKD |
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Name | |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C13H16O3S |
InChI | InChI=1S/C13H16O3S/c14-13-9-5-4-6-11(13)10-17(15,16)12-7-2-1-3-8-12/h1-3,7-8,10,13-14H,4-6,9H2/b11-10+ |
InChIKey | FVQWQGUAFYQMRX-ZHACJKMWSA-N |
Molecular Weight | 252.0816 |
SMILES | OC1CCCC\C1=C\S(c1ccccc1)(=O)=O |
SPLASH | splash10-03di-9500000000-2ad20c9e9a0e53888ec2 |
Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |