![2-[2-(2-Pyridyl)-ethyl]-acetoacetic acid, ethyl ester](/api/spectrum/D631AJsu1yd/structure.png?h=300&w=458 "2-[2-(2-Pyridyl)-ethyl]-acetoacetic acid, ethyl ester")
| SpectraBase Compound ID | Cip8qvBX7bs |
|---|---|
| InChI | InChI=1S/C13H17NO3/c1-3-17-13(16)12(10(2)15)8-7-11-6-4-5-9-14-11/h4-6,9,12H,3,7-8H2,1-2H3 |
| InChIKey | HXTPGVVMOXURSQ-UHFFFAOYSA-N |
| Mol Weight | 235.28 g/mol |
| Molecular Formula | C13H17NO3 |
| Exact Mass | 235.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D631AJsu1yd |
|---|---|
| Name | 2-[2-(2-Pyridyl)-ethyl]-acetoacetic acid, ethyl ester |
| CAS Registry Number | 92041-81-1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H17NO3 |
| InChI | InChI=1S/C13H17NO3/c1-3-17-13(16)12(10(2)15)8-7-11-6-4-5-9-14-11/h4-6,9,12H,3,7-8H2,1-2H3 |
| InChIKey | HXTPGVVMOXURSQ-UHFFFAOYSA-N |
| Instrument Name | Varian HA-100 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |