| SpectraBase Compound ID | HQ8g4Rg06gu |
|---|---|
| InChI | InChI=1S/C10H14O2/c1-7(11)12-10-6-5-8-3-2-4-9(8)10/h2,4,8-10H,3,5-6H2,1H3/t8-,9-,10+/m0/s1 |
| InChIKey | DXTQBCHKMLBUMI-LPEHRKFASA-N |
| Mol Weight | 166.22 g/mol |
| Molecular Formula | C10H14O2 |
| Exact Mass | 166.09938 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4GoY78IDr8F |
|---|---|
| Name | 1-Pentalenol, 1,2,3,3a,4,6a-hexahydro-, acetate, (1.alpha.,3a.beta.,6a.beta.)-(.+-.)- |
| CAS Registry Number | 120584-39-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H14O2 |
| InChI | InChI=1S/C10H14O2/c1-7(11)12-10-6-5-8-3-2-4-9(8)10/h2,4,8-10H,3,5-6H2,1H3/t8-,9-,10+/m0/s1 |
| InChIKey | DXTQBCHKMLBUMI-LPEHRKFASA-N |
| Molecular Weight | 166.220 g/mol |
| SMILES | [C@]1([C@]2(C=CC[C@@]2([H])CC1)[H])(OC(=O)C)[H] |
| SPLASH | splash10-0a6s-9300000000-ecdddfc25c21e6eb23ae |
| Source of Spectrum | KC-1988-1126-14 |
| Synonyms | (1R,3aR,6aR)-1,2,3,3a,4,6a-hexahydro-1-pentalenyl acetate Acetic acid[(1R,3aR,6aR)-1,2,3,3a,4,6a-hexahydropentalen-1-yl]ester Bicyclo[3.3.0]oct-7-en-2-ol [(1R,3aR,6aR)-1,2,3,3a,4,6a-hexahydropentalen-1-yl]acetate [(1R,3aR,6aR)-1,2,3,3a,4,6a-hexahydropentalen-1-yl]ethanoate [(1R,3aR,6aR)-1,2,3,3a,4,6a-hexahydropentalen-1-yl] acetate [(1R,3aR,6aR)-1,2,3,3a,4,6a-hexahydropentalen-1-yl] ethanoate |
| Wiley ID | 1162708 |