| SpectraBase Compound ID | L0o4u1j7mgm |
|---|---|
| InChI | InChI=1S/C9H12O2S/c1-6(2)9(10)12-8-4-5-11-7(8)3/h4-6H,1-3H3 |
| InChIKey | ABFMKGKWFCBYIY-UHFFFAOYSA-N |
| Mol Weight | 184.25 g/mol |
| Molecular Formula | C9H12O2S |
| Exact Mass | 184.055801 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HrlFnrOouFW |
|---|---|
| Name | S-(2-Methyl-3-furyl)-2-methylpropanethioate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.055800798 u |
| Formula | C9H12O2S |
| InChI | InChI=1S/C9H12O2S/c1-6(2)9(10)12-8-4-5-11-7(8)3/h4-6H,1-3H3 |
| InChIKey | ABFMKGKWFCBYIY-UHFFFAOYSA-N |
| Molecular Weight | 184.253 g/mol |
| SMILES | C1=CC(SC(C(C)C)=O)=C(O1)C |