| SpectraBase Compound ID | 5Fi5udRTGZ7 |
|---|---|
| InChI | InChI=1S/C8H16O/c1-3-4-5-6-7-8(2)9/h3-7H2,1-2H3 |
| InChIKey | ZPVFWPFBNIEHGJ-UHFFFAOYSA-N |
| Mol Weight | 128.21 g/mol |
| Molecular Formula | C8H16O |
| Exact Mass | 128.120115 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LsfGwcEDmBm |
|---|---|
| Name | octan-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H16O |
| InChI | InChI=1S/C8H16O/c1-3-4-5-6-7-8(2)9/h3-7H2,1-2H3 |
| InChIKey | ZPVFWPFBNIEHGJ-UHFFFAOYSA-N |
| Instrument Name | GCMS |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/cctc.202002011 |
| Molecular Weight | 128.215 g/mol |
| SMILES | C(C(=O)C)CCCCC |
| SPLASH | splash10-0a4l-9000000000-87a7c0e8be36be6748de |
| Source of Spectrum | CCC-13-SM16-2b |
| Wiley ID | 1854343 |