| SpectraBase Compound ID | 5AWshKJGzdg |
|---|---|
| InChI | InChI=1S/C8H10O4/c1-6(9)12-7-2-3-8(10)11-5-4-7/h2-3,7H,4-5H2,1H3 |
| InChIKey | WRYHUONLVXFXHZ-UHFFFAOYSA-N |
| Mol Weight | 170.16 g/mol |
| Molecular Formula | C8H10O4 |
| Exact Mass | 170.057909 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AxUuEER6YaB |
|---|---|
| Name | 5-Acetoxy-6,7-dihydro-2(5H)-oxepinone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H10O4 |
| InChI | InChI=1S/C8H10O4/c1-6(9)12-7-2-3-8(10)11-5-4-7/h2-3,7H,4-5H2,1H3 |
| InChIKey | WRYHUONLVXFXHZ-UHFFFAOYSA-N |
| Molecular Weight | 170.164 g/mol |
| SMILES | C1(C=CC(OC(=O)C)CCO1)=O |
| SPLASH | splash10-0006-9100000000-a0f262c95ef19e126f0a |
| Source of Spectrum | H1-40-394-8 |
| Synonyms | 7-Oxo-2,3,4,7-tetrahydro-4-oxepinyl acetate |
| Wiley ID | 756888 |