| SpectraBase Compound ID | 2RnhA6bCNa9 |
|---|---|
| InChI | InChI=1S/C6H8O2/c7-6-4-2-1-3-5-8-6/h2,4H,1,3,5H2 |
| InChIKey | QKRUPRBAQFNCCY-UHFFFAOYSA-N |
| Mol Weight | 112.13 g/mol |
| Molecular Formula | C6H8O2 |
| Exact Mass | 112.052429 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4wZzLWvHI8 |
|---|---|
| Name | 2(5H)-Oxepinone, 6,7-dihydro- |
| CAS Registry Number | 57205-07-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H8O2 |
| InChI | InChI=1S/C6H8O2/c7-6-4-2-1-3-5-8-6/h2,4H,1,3,5H2 |
| InChIKey | QKRUPRBAQFNCCY-UHFFFAOYSA-N |
| Molecular Weight | 112.128 g/mol |
| SMILES | C1(=O)C=CCCCO1 |
| SPLASH | splash10-0ul9-9000000000-49631291ed7f39ec1ef7 |
| Synonyms | 6,7-Dihydro-2(5H)-oxepinone 3,4-Dihydro-2H-oxepin-7-one |
| Wiley ID | 1502064 |