| SpectraBase Compound ID | 3IciogejQgh |
|---|---|
| InChI | InChI=1S/C8H12O/c9-8-5-4-6-2-1-3-7(6)8/h6-7H,1-5H2 |
| InChIKey | NZTVVUIIJPWANB-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 | 3a6E3vrvqa1 |
|---|---|
| Name | 3,3a,4,5,6,6a-hexahydro-2H-pentalen-1-one |
| Alternate Name(s) | Hexahydro-1(2H)-pentalenone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12O |
| InChI | InChI=1S/C8H12O/c9-8-5-4-6-2-1-3-7(6)8/h6-7H,1-5H2 |
| InChIKey | NZTVVUIIJPWANB-UHFFFAOYSA-N |
| Molecular Weight | 124.183 g/mol |
| SMILES | C1(C2C(CCC2)CC1)=O |
| SPLASH | splash10-014i-9000000000-75b20c0daf9eb19518fd |
| Source of Spectrum | G-64-1810-10 |
| Wiley ID | 749574 |