| SpectraBase Compound ID | Lu1FjVfqqOo |
|---|---|
| InChI | InChI=1S/C30H50O/c1-19(2)21-9-11-24-27(21,5)15-17-30(8)25-13-14-26(4)20(3)22(31)10-12-23(26)28(25,6)16-18-29(24,30)7/h19-21,23-25H,9-18H2,1-8H3/t20-,21+,23?,24+,25?,26+,27+,28-,29-,30+/m0/s1 |
| InChIKey | TWHJFXMQVDTKEL-WCZPEPMHSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C30H50O |
| Exact Mass | 426.386166 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7KLCNpGCM4P |
|---|---|
| Name | Filican-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50O |
| InChI | InChI=1S/C30H50O/c1-19(2)21-9-11-24-27(21,5)15-17-30(8)25-13-14-26(4)20(3)22(31)10-12-23(26)28(25,6)16-18-29(24,30)7/h19-21,23-25H,9-18H2,1-8H3/t20-,21+,23?,24+,25?,26+,27+,28-,29-,30+/m0/s1 |
| InChIKey | TWHJFXMQVDTKEL-WCZPEPMHSA-N |
| Molecular Weight | 426.729 g/mol |
| SMILES | [C@]12([C@@](C3CC[C@]4(C([C@@]3(CC2)C)CCC(=O)[C@@]4(C)[H])C)(CC[C@]2([C@]1(CC[C@@]2(C(C)C)[H])[H])C)C)C |
| SPLASH | splash10-0006-0894600000-b11dab6cd38e61a1125d |
| Source of Spectrum | E1-40-1689-0 |
| Wiley ID | 1519544 |