| SpectraBase Compound ID | BrRUYPVJR4W |
|---|---|
| InChI | InChI=1S/C8H13NO2/c1-3-7(10)5-8-4-6(2)9-11-8/h8H,3-5H2,1-2H3 |
| InChIKey | HHPFZSGSVFTZQR-UHFFFAOYSA-N |
| Mol Weight | 155.2 g/mol |
| Molecular Formula | C8H13NO2 |
| Exact Mass | 155.094629 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | C5ShbyCsl8S |
|---|---|
| Name | 5-(2-Oxobutyl)-3-methyl-2-isoxazoline |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H13NO2 |
| InChI | InChI=1S/C8H13NO2/c1-3-7(10)5-8-4-6(2)9-11-8/h8H,3-5H2,1-2H3 |
| InChIKey | HHPFZSGSVFTZQR-UHFFFAOYSA-N |
| Molecular Weight | 155.197 g/mol |
| SMILES | C1(ON=C(C1)C)CC(=O)CC |
| SPLASH | splash10-001i-9100000000-ae311f7d88a43d6fbd83 |
| Source of Spectrum | AJ-64-379-4 |
| Synonyms | 1-(3-Methyl-4,5-dihydro-5-isoxazolyl)-2-butanone |
| Wiley ID | 1152784 |