| SpectraBase Compound ID | B5dRnkhA2Sn |
|---|---|
| InChI | InChI=1S/C15H22O2/c1-9(2)11-5-6-15(4)12(7-11)10(3)13(16)8-14(15)17/h11,14,17H,1,5-8H2,2-4H3/t11-,14-,15-/m1/s1 |
| InChIKey | MROVETGJOLYNJI-KCPJHIHWSA-N |
| Mol Weight | 234.34 g/mol |
| Molecular Formula | C15H22O2 |
| Exact Mass | 234.16198 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HPorUoauzl4 |
|---|---|
| Name | 1.beta.-Hydroxy-.alpha.-cyperone |
| Alternate Name(s) | (4R,4aR,7R)-4-hydroxy-1,4a-dimethyl-7-(1-methylethenyl)-3,4,5,6,7,8-hexahydronaphthalen-2-one (4R,4aR,7R)-4-hydroxy-1,4a-dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one (4R,4aR,7R)-1,4a-dimethyl-4-oxidanyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H22O2 |
| InChI | InChI=1S/C15H22O2/c1-9(2)11-5-6-15(4)12(7-11)10(3)13(16)8-14(15)17/h11,14,17H,1,5-8H2,2-4H3/t11-,14-,15-/m1/s1 |
| InChIKey | MROVETGJOLYNJI-KCPJHIHWSA-N |
| Molecular Weight | 234.339 g/mol |
| SMILES | O[C@]1([C@]2(C(=C(C(C1)=O)C)C[C@](C(=C)C)(CC2)[H])C)[H] |
| SPLASH | splash10-0002-0910000000-d6fc6b240d5bfbc5183f |
| Source of Spectrum | QA-46-255-6 |
| Wiley ID | 863149 |