| SpectraBase Compound ID | ChYHlG0RSjL |
|---|---|
| InChI | InChI=1S/C14H13NO5S/c1-11-2-8-14(9-3-11)21(18,19)20-10-12-4-6-13(7-5-12)15(16)17/h2-9H,10H2,1H3 |
| InChIKey | QXTKWWMLNUQOLB-UHFFFAOYSA-N |
| Mol Weight | 307.32 g/mol |
| Molecular Formula | C14H13NO5S |
| Exact Mass | 307.051444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9H01Xl6lIGi |
|---|---|
| Name | 4-Toluenesulfonic acid, 4-nitro-benzyl ester |
| CAS Registry Number | 4450-68-4 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C14H13NO5S |
| InChI | InChI=1S/C14H13NO5S/c1-11-2-8-14(9-3-11)21(18,19)20-10-12-4-6-13(7-5-12)15(16)17/h2-9H,10H2,1H3 |
| InChIKey | QXTKWWMLNUQOLB-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |