| SpectraBase Compound ID | BA0HQKIIoFS |
|---|---|
| InChI | InChI=1S/C8H12O/c9-8-4-6-2-1-3-7(6)5-8/h6-7H,1-5H2 |
| InChIKey | ZOUYMLXOFDNVRK-UHFFFAOYSA-N |
| Mol Weight | 124.18 g/mol |
| Molecular Formula | C8H12O |
| Exact Mass | 124.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DujmUeIySIc |
|---|---|
| Name | 3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12O |
| InChI | InChI=1S/C8H12O/c9-8-4-6-2-1-3-7(6)5-8/h6-7H,1-5H2 |
| InChIKey | ZOUYMLXOFDNVRK-UHFFFAOYSA-N |
| Molecular Weight | 124.183 g/mol |
| SMILES | C1(CC2CCCC2C1)=O |
| SPLASH | splash10-015i-9000000000-8764d917584c203e016b |
| Source of Spectrum | J-61-8894-6 |
| Synonyms | Hexahydro-2(1H)-pentalenone |
| Wiley ID | 1129099 |