| SpectraBase Compound ID | CX8Ct3xuc1F |
|---|---|
| InChI | InChI=1S/2C7H10O3/c2*1-5(8)3-7(10)4-6(2)9/h3-4H2,1-2H3;3-4,8-9H,1-2H3 |
| InChIKey | LOCVQPZCPWJIND-UHFFFAOYSA-N |
| Mol Weight | 142.15 g/mol |
| Molecular Formula | C7H10O3 |
| Exact Mass | 142.062994 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KooHFdJCoSO |
|---|---|
| Name | 2,4,6-HEPTANETRIONE |
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H10O3 |
| InChI | InChI=1S/2C7H10O3/c2*1-5(8)3-7(10)4-6(2)9/h3-4H2,1-2H3;3-4,8-9H,1-2H3 |
| InChIKey | LOCVQPZCPWJIND-UHFFFAOYSA-N |
| Molecular Weight | 142.16 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300 |
| Synonyms | HEPTANETRIONE, 2,4,6-, 2,5-HEPTADIEN-4-ONE, 2,6-DIHYDROXY-, |