| SpectraBase Compound ID | LdKwGRpq1Es |
|---|---|
| InChI | InChI=1S/C8H12O3S/c9-12(10)6-5-11-7-3-1-2-4-8(7)12/h5-8H,1-4H2 |
| InChIKey | YJZBARRNMZECDB-UHFFFAOYSA-N |
| Mol Weight | 188.24 g/mol |
| Molecular Formula | C8H12O3S |
| Exact Mass | 188.050715 g/mol |
17O Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KBu9QnlCY93 |
|---|---|
| Name | trans-4a,5,6,7,8,8a-Hexahydro-1,4-benzoxathiin 4,4-dioxide |
| CAS Registry Number | 80345-66-0 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H12O3S |
| InChI | InChI=1S/C8H12O3S/c9-12(10)6-5-11-7-3-1-2-4-8(7)12/h5-8H,1-4H2 |
| InChIKey | YJZBARRNMZECDB-UHFFFAOYSA-N |
| Instrument Name | SF = 250 MHz |
| Literature Reference | Org. Magn. Resonance 22, 747 (1984). |
| NMR Standard | not reported |
| Observed nucleus | 17O |
| Solvent | not reported |