| SpectraBase Compound ID | 59sGwdKnHEt |
|---|---|
| InChI | InChI=1S/C13H22O2/c1-4-6-7-8-9-12(11(3)14)10-13(15)5-2/h9H,4-8,10H2,1-3H3/b12-9+ |
| InChIKey | JDOMYAWTUNKCSG-FMIVXFBMSA-N |
| Mol Weight | 210.32 g/mol |
| Molecular Formula | C13H22O2 |
| Exact Mass | 210.16198 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | V2OScGnXFg |
|---|---|
| Name | (3E)-3-hexylideneheptane-2,5-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H22O2 |
| InChI | InChI=1S/C13H22O2/c1-4-6-7-8-9-12(11(3)14)10-13(15)5-2/h9H,4-8,10H2,1-3H3/b12-9+ |
| InChIKey | JDOMYAWTUNKCSG-FMIVXFBMSA-N |
| Molecular Weight | 210.317 g/mol |
| SMILES | C(\C(CC(=O)CC)=C\CCCCC)(=O)C |
| SPLASH | splash10-0a4i-9210000000-89c9433ba2aaa3864387 |
| Source of Spectrum | SO-0-298-3 |
| Wiley ID | 877311 |