| SpectraBase Compound ID | 8hkIq8DEXke |
|---|---|
| InChI | InChI=1S/C6H10O2/c7-6-4-2-1-3-5-8-6/h1-5H2 |
| InChIKey | PAPBSGBWRJIAAV-UHFFFAOYSA-N |
| Mol Weight | 114.14 g/mol |
| Molecular Formula | C6H10O2 |
| Exact Mass | 114.06808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EhdTNeoXIFs |
|---|---|
| Name | 2-OXEPANONE |
| Source of Sample | Eastman Organic Chemicals, Rochester, New York |
| Boiling Point | 108C/10mm |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H10O2 |
| InChI | InChI=1S/C6H10O2/c7-6-4-2-1-3-5-8-6/h1-5H2 |
| InChIKey | PAPBSGBWRJIAAV-UHFFFAOYSA-N |
| Molecular Weight | 114.15 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms | HEXANOIC ACID, 6-HYDROXY-, E- LACTONE |