| SpectraBase Compound ID | 99jAXE64w6k |
|---|---|
| InChI | InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3 |
| InChIKey | NTIZESTWPVYFNL-UHFFFAOYSA-N |
| Mol Weight | 100.16 g/mol |
| Molecular Formula | C6H12O |
| Exact Mass | 100.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IyiT2XK0kqb |
|---|---|
| Name | 4-Methyl-2-pentanone |
| Comments | MONAID: JP006449 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H12O |
| InChI | InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3 |
| InChIKey | NTIZESTWPVYFNL-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 100.161 g/mol |
| SMILES | CC(C)CC(C)=O |
| SPLASH | splash10-052f-9000000000-7ae095bf973337f87909 |
| Source of Spectrum | SRH-2022-6449-0 |
| Wiley ID | 1828279 |