| SpectraBase Compound ID | 7qiIwiADoRk |
|---|---|
| InChI | InChI=1S/C6H9NO2/c1-4-6(3-8)5(2)9-7-4/h8H,3H2,1-2H3 |
| InChIKey | JISPGFYJPXGNBY-UHFFFAOYSA-N |
| Mol Weight | 127.14 g/mol |
| Molecular Formula | C6H9NO2 |
| Exact Mass | 127.063329 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6uMzihzkkO4 |
|---|---|
| Name | 3,5-Dimethyl-4-hydroxymethyl-isoxazole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H9NO2 |
| InChI | InChI=1S/C6H9NO2/c1-4-6(3-8)5(2)9-7-4/h8H,3H2,1-2H3 |
| InChIKey | JISPGFYJPXGNBY-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 127.143 g/mol |
| SMILES | OCc1c(C)noc1C |
| SPLASH | splash10-0036-9400000000-86d97ea691dbd41af15c |
| Source of Spectrum | SRH-2022-3232-0 |
| Wiley ID | 1825517 |