![ISOPROPYL-PHENYL-SULPHOXIDE;[(1-METHYLETHYL)-SULFINYL]-BENZENE](/api/spectrum/2W0gRVIhjif/structure.png?h=300&w=458 "ISOPROPYL-PHENYL-SULPHOXIDE;[(1-METHYLETHYL)-SULFINYL]-BENZENE")
| SpectraBase Compound ID | r6XMan4CYt |
|---|---|
| InChI | InChI=1S/C9H12OS/c1-8(2)11(10)9-6-4-3-5-7-9/h3-8H,1-2H3 |
| InChIKey | MNPISBRDBQCTAF-UHFFFAOYSA-N |
| Mol Weight | 168.25 g/mol |
| Molecular Formula | C9H12OS |
| Exact Mass | 168.060886 g/mol |
17O Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2W0gRVIhjif |
|---|---|
| Name | Isopropyl-phenyl-sulphoxide |
| CAS Registry Number | 4170-69-8 |
| Comments | 1;2-DIBROMOETHANE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H12OS |
| InChI | InChI=1S/C9H12OS/c1-8(2)11(10)9-6-4-3-5-7-9/h3-8H,1-2H3 |
| InChIKey | MNPISBRDBQCTAF-UHFFFAOYSA-N |
| Instrument Name | SF = 400 MHz |
| Literature Reference | Magn. Res. Chem. 24, 792 (1986). |
| NMR Standard | not reported |
| Observed nucleus | 17O |
| Solvent | H2O |