| SpectraBase Compound ID | 8RViBYOsmmn |
|---|---|
| InChI | InChI=1S/C8H14O/c1-3-5-6-7-8(9)4-2/h4H,2-3,5-7H2,1H3 |
| InChIKey | KLTVSWGXIAYTHO-UHFFFAOYSA-N |
| Mol Weight | 126.2 g/mol |
| Molecular Formula | C8H14O |
| Exact Mass | 126.104465 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FU90URhEX0M |
|---|---|
| Name | oct-1-en-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H14O |
| InChI | InChI=1S/C8H14O/c1-3-5-6-7-8(9)4-2/h4H,2-3,5-7H2,1H3 |
| InChIKey | KLTVSWGXIAYTHO-UHFFFAOYSA-N |
| Instrument Name | GCMS |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/cctc.202002011 |
| Molecular Weight | 126.199 g/mol |
| SMILES | CCCCCC(C=C)=O |
| SPLASH | splash10-0006-9000000000-a91906f047d39556820e |
| Source of Spectrum | CCC-13-SM9-1 |
| Wiley ID | 1854334 |