| SpectraBase Compound ID | J3Fez4FCi58 |
|---|---|
| InChI | InChI=1S/C12H24O2/c1-4-5-6-7-8-12(13)14-10-9-11(2)3/h11H,4-10H2,1-3H3 |
| InChIKey | AFCXVDRTNQNGHS-UHFFFAOYSA-N |
| Mol Weight | 200.32 g/mol |
| Molecular Formula | C12H24O2 |
| Exact Mass | 200.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CupppMZbHJR |
|---|---|
| Name | Heptanoic acid, 3-methyl-butyl ester |
| CAS Registry Number | 109-25-1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H24O2 |
| InChI | InChI=1S/C12H24O2/c1-4-5-6-7-8-12(13)14-10-9-11(2)3/h11H,4-10H2,1-3H3 |
| InChIKey | AFCXVDRTNQNGHS-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |