| SpectraBase Compound ID | I9zQNX7M7TT |
|---|---|
| InChI | InChI=1S/C15H24O/c1-10(2)13-6-5-12(4)15(13)8-7-11(3)14(16)9-15/h7,10,12-13H,5-6,8-9H2,1-4H3/t12-,13-,15+/m1/s1 |
| InChIKey | HBTHUBMUAHAWBC-NFAWXSAZSA-N |
| Mol Weight | 220.36 g/mol |
| Molecular Formula | C15H24O |
| Exact Mass | 220.182715 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B489ip8Z25w |
|---|---|
| Name | (-)-Acorenone B |
| Alternate Name(s) | Spiro[4.5]dec-8-en-7-one, 1,8-dimethyl-4-(1-methylethyl)-, [1S-(1.alpha.,4.alpha.,5.beta.)]- Spiro[4.5]dec-8-en-7-one, 1,8-dimethyl-4-(1-methylethyl)-, (1.alpha.,4.alpha.,5.alpha.)-(.+-.)- (.+-.)-Acorenone (1R,4R,5S)-1-isopropyl-4,8-dimethylspiro[4.5]dec-8-en-7-one Spiro[4.5]dec-8-en-7-one, 1-isopropyl-4,8-dimethyl- 1,4-cis-1,7-trans-acorenone 1,4-trans-1,7-cis-acorenone rel.-(1S,4S,5S)-1-isopropyl-4,8-dimethyl-spiro(4.5)dec-8-en-ol. |
| CAS Registry Number | 63865-67-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H24O |
| InChI | InChI=1S/C15H24O/c1-10(2)13-6-5-12(4)15(13)8-7-11(3)14(16)9-15/h7,10,12-13H,5-6,8-9H2,1-4H3/t12-,13-,15+/m1/s1 |
| InChIKey | HBTHUBMUAHAWBC-NFAWXSAZSA-N |
| Molecular Weight | 220.356 g/mol |
| SMILES | [C@]12(CC(=O)C(=CC2)C)[C@](CC[C@]1(C)[H])(C(C)C)[H] |
| SPLASH | splash10-05ar-5940000000-62505bf0dea29a1738a4 |
| Source of Spectrum | F-33-577-0 |
| Wiley ID | 1220543 |