| SpectraBase Compound ID | B2flOcVT0x7 |
|---|---|
| InChI | InChI=1S/C16H32O2/c1-3-5-7-9-10-11-13-15-18-16(17)14-12-8-6-4-2/h3-15H2,1-2H3 |
| InChIKey | XCQXSYSIKVLBKE-UHFFFAOYSA-N |
| Mol Weight | 256.4 g/mol |
| Molecular Formula | C16H32O2 |
| Exact Mass | 256.24023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LiCz3MJLTVQ |
|---|---|
| Name | HEPTANOIC ACID, NONYL ESTER |
| Source of Sample | M. Dymicky, U.S. Dept. of Agriculture, Errc, Philadelphia, Pennsylvania |
| Boiling Point | 95-97C/0.1mm |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H32O2 |
| InChI | InChI=1S/C16H32O2/c1-3-5-7-9-10-11-13-15-18-16(17)14-12-8-6-4-2/h3-15H2,1-2H3 |
| InChIKey | XCQXSYSIKVLBKE-UHFFFAOYSA-N |
| Molecular Weight | 256.43 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |