SpectraBase Compound ID | K0Mtz8Jvv24 |
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InChI | InChI=1S/C13H18O3S/c1-11-7-9-13(10-8-11)17(14,15)16-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3 |
InChIKey | OHHPZPDQZMUTCA-UHFFFAOYSA-N |
Mol Weight | 254.34 g/mol |
Molecular Formula | C13H18O3S |
Exact Mass | 254.097666 g/mol |
SpectraBase Spectrum ID | ip935G0eZR |
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Name | |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C13H17O3SD |
InChI | InChI=1S/C13H18O3S/c1-11-7-9-13(10-8-11)17(14,15)16-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3 |
InChIKey | OHHPZPDQZMUTCA-UHFFFAOYSA-N |
Molecular Weight | 254.0972 |
SMILES | c1(S(OC2CCCCC2)(=O)=O)ccc(C)cc1 |
SPLASH | splash10-00sl-9200000000-8b8f1529d0256f30193b |
Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |