| SpectraBase Compound ID | 9RWWTJIzRjo |
|---|---|
| InChI | InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h5-6H,3-4H2,1-2H3/b6-5+ |
| InChIKey | JHHZQADGLDKIPM-AATRIKPKSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
| SpectraBase Spectrum ID | 8aJST4jwO3Q |
|---|---|
| Name | trans-3-HEPTEN-2-ONE |
| Source of Sample | Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan |
| Copyright | Copyright © 1991-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h5-6H,3-4H2,1-2H3/b6-5+ |
| InChIKey | JHHZQADGLDKIPM-AATRIKPKSA-N |
| Instrument Name | BRUKER AC-300 |
| Molecular Weight | 112.17 |
| Solvent | CDCl3; Reference=TMS; Temperature 297K |