| SpectraBase Compound ID | FjIW1ffuT9r |
|---|---|
| InChI | InChI=1S/C7H11NO/c1-2-4-7(9)5-3-6-8/h2-5H2,1H3 |
| InChIKey | QQKDGOHRFRUUDP-UHFFFAOYSA-N |
| Mol Weight | 125.17 g/mol |
| Molecular Formula | C7H11NO |
| Exact Mass | 125.084064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 2jmVripoOyh |
|---|---|
| Name | 4-OXOHEPTANENITRILE |
| Source of Sample | H. Stetter, Institute of Organic Chemistry, Aachen, Germany |
| Boiling Point | 117C/10mm |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H11NO |
| InChI | InChI=1S/C7H11NO/c1-2-4-7(9)5-3-6-8/h2-5H2,1H3 |
| InChIKey | QQKDGOHRFRUUDP-UHFFFAOYSA-N |
| Molecular Weight | 125.17 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms | HEPTANENITRILE, 4-OXO-, |