| SpectraBase Compound ID | KSdwcNP1bUq |
|---|---|
| InChI | InChI=1S/C16H26/c1-10(2)12-7-9-15(4)13-11(3)6-8-16(15,5)14(12)13/h6,10,12-14H,7-9H2,1-5H3/t12-,13+,14+,15?,16-/m0/s1 |
| InChIKey | NWUNRENQMBWNPR-MHEXCUPBSA-N |
| Mol Weight | 218.38 g/mol |
| Molecular Formula | C16H26 |
| Exact Mass | 218.203451 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8Y9n7rJxqPV |
|---|---|
| Name | (-)-a-copaene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H26 |
| InChI | InChI=1S/C16H26/c1-10(2)12-7-9-15(4)13-11(3)6-8-16(15,5)14(12)13/h6,10,12-14H,7-9H2,1-5H3/t12-,13+,14+,15?,16-/m0/s1 |
| InChIKey | NWUNRENQMBWNPR-MHEXCUPBSA-N |
| Molecular Weight | 218.384 g/mol |
| SMILES | [C@@]12(C3(CC[C@]([C@@]2([C@]3(C(=CC1)C)[H])[H])(C(C)C)[H])C)C |
| SPLASH | splash10-0cdi-3900000000-df49ea647cfb582fad50 |
| Source of Spectrum | B-47-587-0 |
| Wiley ID | 1218502 |