| SpectraBase Compound ID | KDeHk6vHUJT |
|---|---|
| InChI | InChI=1S/C11H22O2/c1-4-5-6-7-8-11(12)13-9-10(2)3/h10H,4-9H2,1-3H3 |
| InChIKey | HXJOYVPESRRCDB-UHFFFAOYSA-N |
| Mol Weight | 186.29 g/mol |
| Molecular Formula | C11H22O2 |
| Exact Mass | 186.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A79wnf65neu |
|---|---|
| Name | Heptanoic acid, isobutyl ester |
| CAS Registry Number | 7779-80-8 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H22O2 |
| InChI | InChI=1S/C11H22O2/c1-4-5-6-7-8-11(12)13-9-10(2)3/h10H,4-9H2,1-3H3 |
| InChIKey | HXJOYVPESRRCDB-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |