| SpectraBase Compound ID | 1R11nzqZcZS |
|---|---|
| InChI | InChI=1S/C8H12O/c9-8-5-4-6-2-1-3-7(6)8/h6-7H,1-5H2/t6-,7-/m1/s1 |
| InChIKey | NZTVVUIIJPWANB-RNFRBKRXSA-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 | AyDZJpvAx0a |
|---|---|
| Name | (3aR,6aR)-3,3a,4,5,6,6a-hexahydro-2H-pentalen-1-one |
| CAS Registry Number | 32405-37-1 |
| 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/t6-,7-/m1/s1 |
| InChIKey | NZTVVUIIJPWANB-RNFRBKRXSA-N |
| Molecular Weight | 124.183 g/mol |
| SMILES | C1([C@]2([C@@](CCC2)([H])CC1)[H])=O |
| SPLASH | splash10-015a-9100000000-ca8e09d7c50b5a48c572 |
| Source of Spectrum | F-38-2432-0 |
| Wiley ID | 1128998 |