| SpectraBase Compound ID | LA6fngUhkLE |
|---|---|
| InChI | InChI=1S/C15H22O/c1-11-5-4-7-15(3)8-6-13(9-14(11)15)12(2)10-16/h5,10,13-14H,2,4,6-9H2,1,3H3/t13-,14+,15-/m1/s1 |
| InChIKey | NNWMSIPNQKPGRM-QLFBSQMISA-N |
| Mol Weight | 218.34 g/mol |
| Molecular Formula | C15H22O |
| Exact Mass | 218.167065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1lT9LUbNJo |
|---|---|
| Name | (-)-Oxo-.alpha.-selinene |
| CAS Registry Number | 4586-01-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H22O |
| InChI | InChI=1S/C15H22O/c1-11-5-4-7-15(3)8-6-13(9-14(11)15)12(2)10-16/h5,10,13-14H,2,4,6-9H2,1,3H3/t13-,14+,15-/m1/s1 |
| InChIKey | NNWMSIPNQKPGRM-QLFBSQMISA-N |
| Molecular Weight | 218.340 g/mol |
| SMILES | [C@@]12(C[C@](C(=C)C=O)(CC[C@]2(CCC=C1C)C)[H])[H] |
| SPLASH | splash10-052f-9320000000-e0a961783a831d348bc8 |
| Source of Spectrum | H-60-2188-0 |
| Synonyms | .alpha.-Costal 2-((2R,4aR,8aR)-4a,8-Dimethyl-1,2,3,4,4a,5,6,8a-octahydro-naphthalen-2-yl)-propenal 2-Naphthaleneacetaldehyde, 1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-.alpha.-methylene-, [2R-(2.alpha.,4a.alpha.,8a.beta.)]- Eudesma-3,11(13)-dien-12-al 2-[(2R,4aR,8aR)-4a,8-dimethyl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-2-yl]-2-propenal 2-[(2R,4aR,8aR)-4a,8-dimethyl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-2-yl]acrolein 2-[(2R,4aR,8aR)-4a,8-dimethyl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-2-yl]prop-2-enal |
| Wiley ID | 1218211 |