| SpectraBase Compound ID | 1QijH6FXjYY |
|---|---|
| InChI | InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9) |
| InChIKey | MNWFXJYAOYHMED-UHFFFAOYSA-N |
| Mol Weight | 130.19 g/mol |
| Molecular Formula | C7H14O2 |
| Exact Mass | 130.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GeQmsMOb8gY |
|---|---|
| Name | Heptanoic acid |
| CAS Registry Number | 111-14-8 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C7H14O2 |
| InChI | InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9) |
| InChIKey | MNWFXJYAOYHMED-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Literature Reference | P.A. Couperus, A.D. Clague, Org. Magn. Resonance 11, 590 (1978). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |