| SpectraBase Compound ID | 8t6BwIwZPmN |
|---|---|
| InChI | InChI=1S/C33H54/c1-9-10-12-24(2)13-14-25(3)23-26-17-21-32(7)27(26)15-16-29-31(6)20-11-19-30(4,5)28(31)18-22-33(29,32)8/h9,13,26-29H,1,3,10-12,14-23H2,2,4-8H3/b24-13+/t26-,27+,28-,29+,31-,32+,33+/m0/s1 |
| InChIKey | UCZUURQIYTYMHV-GBHGUOJFSA-N |
| Mol Weight | 450.8 g/mol |
| Molecular Formula | C33H54 |
| Exact Mass | 450.422552 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6rLsbZsjIOG |
|---|---|
| Name | (17 R)-17-(2'-Methylene-5'-methylnona-4',8'-dienyl)-dammarene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 450.422551739 u |
| Formula | C33H54 |
| InChI | InChI=1S/C33H54/c1-9-10-12-24(2)13-14-25(3)23-26-17-21-32(7)27(26)15-16-29-31(6)20-11-19-30(4,5)28(31)18-22-33(29,32)8/h9,13,26-29H,1,3,10-12,14-23H2,2,4-8H3/b24-13+/t26-,27+,28-,29+,31-,32+,33+/m0/s1 |
| InChIKey | UCZUURQIYTYMHV-GBHGUOJFSA-N |
| Molecular Weight | 450.795 g/mol |
| SMILES | [C@]12([C@]3([C@]([C@@](CC(=C)C\C=C\(CCC=C)C)([H])CC3)([H])CC[C@@]2([C@]2(CCCC([C@@]2(CC1)[H])(C)C)C)[H])C)C |