SpectraBase Compound ID | 6WA4T66WjoH |
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InChI | InChI=1S/C8H16OS/c1-6-5-10-8(3,4)9-7(6)2/h6-7H,5H2,1-4H3 |
InChIKey | YEYSKLYLBSRPLO-UHFFFAOYSA-N |
Mol Weight | 160.27 g/mol |
Molecular Formula | C8H16OS |
Exact Mass | 160.092186 g/mol |
SpectraBase Spectrum ID | H6PaD8AgsSC |
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Name | 2,2,5,6-Tetramethyl-1,3-oxathiane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 160.092186308 u |
Formula | C8H16OS |
InChI | InChI=1S/C8H16OS/c1-6-5-10-8(3,4)9-7(6)2/h6-7H,5H2,1-4H3 |
InChIKey | YEYSKLYLBSRPLO-UHFFFAOYSA-N |
Molecular Weight | 160.275 g/mol |
SMILES | C1(C(OC(SC1)(C)C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94952 |