| SpectraBase Compound ID | ETZ6iOWD5Vc |
|---|---|
| InChI | InChI=1S/C30H50/c1-22(2)12-9-13-23(3)14-10-15-24(4)25-16-17-27-29(25,7)21-18-26-28(5,6)19-11-20-30(26,27)8/h12,14,25-27H,4,9-11,13,15-21H2,1-3,5-8H3/b23-14+/t25-,26?,27?,29+,30+/m1/s1 |
| InChIKey | HKMNNTWBKGKUAB-GFOBGWPNSA-N |
| Mol Weight | 410.7 g/mol |
| Molecular Formula | C30H50 |
| Exact Mass | 410.391252 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ADnlJY3zk |
|---|---|
| Name | 13.alpha.-H-Marabaricatriene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50 |
| InChI | InChI=1S/C30H50/c1-22(2)12-9-13-23(3)14-10-15-24(4)25-16-17-27-29(25,7)21-18-26-28(5,6)19-11-20-30(26,27)8/h12,14,25-27H,4,9-11,13,15-21H2,1-3,5-8H3/b23-14+/t25-,26?,27?,29+,30+/m1/s1 |
| InChIKey | HKMNNTWBKGKUAB-GFOBGWPNSA-N |
| Molecular Weight | 410.730 g/mol |
| SMILES | [C@]12(C([C@]3(CCCC(C3CC2)(C)C)C)CC[C@@]1(C(=C)CC\C=C\(CCC=C(C)C)C)[H])C |
| SPLASH | splash10-014l-5950000000-07f275de06660f40c21f |
| Source of Spectrum | X2-53-331-6 |
| Wiley ID | 1603423 |