| SpectraBase Compound ID | 5R3Qg5TXhuc |
|---|---|
| InChI | InChI=1S/C11H16O3S/c1-9(2)8-14-15(12,13)11-6-4-10(3)5-7-11/h4-7,9H,8H2,1-3H3 |
| InChIKey | QIMRPGAQCKHRKB-UHFFFAOYSA-N |
| Mol Weight | 228.31 g/mol |
| Molecular Formula | C11H16O3S |
| Exact Mass | 228.082016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HQUPnOc5Sqh |
|---|---|
| Name | P-Toluenesulfonic acid, isobutyl ester |
| CAS Registry Number | 4873-56-7 |
| Comments | REASSIGNED (A.H.) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H16O3S |
| InChI | InChI=1S/C11H16O3S/c1-9(2)8-14-15(12,13)11-6-4-10(3)5-7-11/h4-7,9H,8H2,1-3H3 |
| InChIKey | QIMRPGAQCKHRKB-UHFFFAOYSA-N |
| Instrument Name | Varian HA-100 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |